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| CAS Number | 50892-23-4 |
| Catalog Number | AG003VBY(AGN-PC-0JK7C6) |
| Chemical Name | WY-14643 |
| IUPAC Name | 2-[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]sulfanylacetic acid |
| InChI | InChI=1S/C14H14ClN3O2S/c1-8-4-3-5-10(9(8)2)16-12-6-11(15)17-14(18-12)21-7-13(19)20/h3-6H,7H2,1-2H3,(H,19,20)(H,16,17,18) |
| InChI Key | SZRPDCCEHVWOJX-UHFFFAOYSA-N |
| MDL Number | MFCD00191335 |
| Molecular Formula | C14H14ClN3O2S |
| Molecular Weight | 323.7979 |
| NSC Number | 310038 |
| SMILES | ClC1=NC(=NC(=C1)NC1=C(C(=CC=C1)C)C)SCC(=O)O |
| UNII | 86C4MRT55A |
| Synonyms | (4-chloro-6-(2,3-xylidino)-2-pyrimidinylthio)acetic acid,
4-chloro-6-(2,3-dimethylphenyl)amino-2-pyrimidinylthioacetic acid,
4-chloro-6-(2,3-xylidinyl)-2-pyrimidinylthioacetic acid,
CXPTA,
pirinixic acid,
WY 14,643,
Wy 14643,
WY-14,643,
Wy-14643,
WY14,643,
Wyeth 14,643,
Wyeth-14643,
Pirinixic acid,
50892-23-4,
WY-14643,
[4-Chloro-6-(2,3-xylidino)-2-pyrimidinylthio]acetic acid,
WY-14,643,
WY14643,
Wy 14643,
WY-14643 (Pirinixic Acid),
Wyeth 14,643,
Pirinixic acid [INN],
(4-Chloro-6-(2,3-xylidino)-2-pyrimidinylthio)acetic acid,
UNII-86C4MRT55A,
C14H14ClN3O2S,
CCRIS 133,
NSC 310038,
Acide pirinixique [INN-French],
Acido pirinixico [INN-Spanish],
Acidum pirinixicum [INN-Latin],
NSC310038,
NSC-310038,
BRN 0759945,
((4-Chloro-6-((2,3-dimethylphenyl)amino)-2-pyrimidinyl)thio)acetic acid,
Acetic acid, ((4-chloro-6-((2,3-dimethylphenyl)amino)-2-pyrimidinyl)thio)-,
86C4MRT55A,
CHEMBL295416,
CHEBI:32509,
SZRPDCCEHVWOJX-UHFFFAOYSA-N,
ACETIC ACID, ((4-CHLORO-6-(2,3-XYLIDINO)-2-PYRIMIDINYL)THIO)-,
MFCD00191335,
4-Chloro-6-(2,3-xylidino)-2-pyrimidinylthioacetic acid,
NCGC00014702-03,
DSSTox_CID_290,
2-[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]sulfanylacetic acid,
({4-chloro-6-[(2,3-dimethylphenyl)amino]pyrimidin-2-yl}sulfanyl)acetic acid,
2-({4-Chloro-6-[(2,3-Dimethylphenyl)amino]pyrimidin-2-Yl}sulfanyl)acetic Acid,
Acetic acid, [[4-chloro-6-[(2,3-dimethylphenyl)amino]-2-pyrimidinyl]thio]-,
Wyeth-14,643,
DSSTox_RID_75491,
DSSTox_GSID_20290,
((4-Chloro-6-(2,3-xylidino)-2-pyrimidinyl)thio)acetic acid,
(4-Chloro-6-(2,3-xylidino)-2-pyrimidinylthio) acetic acid,
Acido pirinixico,
Acide pirinixique,
({4-chloro-6-[(2,3-dimethylphenyl)amino]pyrimidin-2-yl}thio)acetic acid,
Acidum pirinixicum,
CAS-50892-23-4,
CXPTA,
SR-01000597401,
Wyeth-14643,
Pirnixic acid,
[[4-Chloro-6-[(2,3-dimethylphenyl)amino]-2-pyrimidinyl]thio]acetic acid,
HSDB 8056,
WY1,
Tocris-1312,
WY14,643,
ACMC-209kqp,
WY 14,643,
AC1L1KXE,
Spectrum5_001947,
wy-14643-pirinixic-acid,
NCIStruc1_001774,
NCIStruc2_001509,
CBiol_001856,
BSPBio_001540,
KBioGR_000260,
KBioGR_002353,
KBioSS_000260,
KBioSS_002356,
5-25-12-00458 (Beilstein Handbook Reference),
JMC515449 Compound 1,
MLS004773935,
SCHEMBL293161,
SPECTRUM1505106,
WY-14643; Pirinixic Acid,
WY14643 (Pirinixic Acid),
BML2-E12,
GTPL2666,
ZINC1963,
DTXSID4020290,
WY 14643 (Pirinixic Acid),
BDBM24566,
CTK3I9349,
KBio2_000260,
KBio2_002353,
KBio2_002828,
KBio2_004921,
KBio2_005396,
KBio2_007489,
KBio3_000519,
KBio3_000520,
KBio3_002832,
4-chloro-6-(2,3-xylidinyl)-2-pyrimidinylthioacetic acid,
cMAP_000028,
Bio1_000142,
Bio1_000631,
Bio1_001120,
Bio2_000260,
Bio2_000740,
HMS1361M22,
HMS1791M22,
HMS1989M22,
HMS3267N11,
HMS3402M22,
HMS3649C12,
HMS3653N21,
HMS3676G06,
BCP21201,
EX-A2258,
Tox21_110058,
Tox21_201609,
Tox21_300634,
4-chloro-6-(2,3-dimethylphenyl)amino-2-pyrimidinylthioacetic acid,
ANW-31151,
BS0206,
CCG-37145,
GL2940,
IN1417,
NCGC00014702,
NCI310038,
s8029,
AKOS015902283,
Tox21_110058_1,
AM81246,
API0015804,
CS-4661,
ES-0025,
LS-1314,
SB19568,
IDI1_034010,
NCGC00014702-02,
NCGC00014702-04,
NCGC00014702-05,
NCGC00014702-06,
NCGC00014702-07,
NCGC00014702-08,
NCGC00014702-09,
NCGC00014702-10,
NCGC00014702-11,
NCGC00014702-12,
NCGC00014702-15,
NCGC00014702-17,
NCGC00025107-01,
NCGC00025107-02,
NCGC00025107-03,
NCGC00025107-04,
NCGC00025107-05,
NCGC00025107-06,
NCGC00025107-07,
NCGC00025107-08,
NCGC00254449-01,
NCGC00259158-01,
4CA-1346,
AK468729,
BC600766,
HY-16995,
NCI60_002666,
SC-95568,
SMR001798898,
DB-051855,
TC-119896,
FT-0602973,
SW203787-2,
Y0478,
Acetic acid,3-xylidino)-2-pyrimidinyl]thio]-,
A12360,
C15617,
S-7756,
TRANSGENIC MODEL EVALUATION (WY-14643),
C-19783,
SR-01000597401-1,
SR-01000597401-3,
SR-01000597401-4,
SR-01000597401-6,
BRD-K01902415-001-02-6,
BRD-K01902415-001-03-4,
I14-13293,
Acetic acid,3-dimethylphenyl)amino]-2-pyrimidinyl]thio]-,
[4-chloro-6-(2,3-xylidino)-2-pyrimidinyl-thio]-acetic acid,
((4-chloro-6-(2,3-dimethylanilino)-2-pyrimidinyl)thio)acetic acid,
(4-CHLORO-6-(2,3-XYLIDINO)-2-PYRIMIDINYL THIO)ACETIC ACID,
([4-Chloro-6-(2,3-dimethylanilino)-2-pyrimidinyl]sulfanyl)acetic acid #,
(4-Chloro-6-(2,3-xylidino)-2-pyrimidinylthio) acetic acid (WY-14643),
[[4-chloro-6-[(2,3-dimethylphenyl)amino]-2-pyrimidinyl]thio]aceticacid,
[4-Chloro-6-(2,3-dimethyl-phenylamino)-pyrimidin-2-ylsulfanyl]-acetic acid,
2-((4-Chloro-6-((2,3-dimethylphenyl)amino)pyrimidin-2-yl)thio)acetic acid,
2-(4-chloro-6-(2,3-dimethylphenylamino)pyrimidin-2-ylthio)acetic acid,
2-[4-chloro-6-[(2,3-dimethylphenyl)amino]pyrimidin-2-yl]sulfanylacetic acid,
Acetic acid, 2-[[4-chloro-6-[(2,3-dimethylphenyl)amino]-2-pyrimidinyl]thio]-,
(4-CHLORO-6-(2,3-XYLIDINO)-2-PYRIMIDINYLTHIO) ACETIC ACID (WY-14643) (SEE ALSO PEROXISOME PROJECT (WY-14643)),
PEROXISOME PROJECT (WY-14643)(SEE ALSO (4-CHLORO-6-(2,3-XYLIDINO)-2-PYRIMIDINYLTHIO) ACETIC ACID (WY-14643)),
D09XCX,
CID5694,
C14-H14-Cl-N3-O2-S,
c1323,
A4305,
C006253,
|
| Complexity | 361 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 323.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 323.795g/mol |
| Monoisotopic Mass | 323.05g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 100A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.2 |
| Symbol: | |
| Hazard Class | |
| Hazard statements | H302-H315-H319-H335 |
| Packing Group | |
| Precautionary statements | P261-P305+P351+P338 |
| UN Code |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
| Quantity: |
| Test: | Result: |

