![Chemical structure of 1,2,4-Triazolo[4,3-a]pyridin-3(2H)-one, 2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-, CAS 19794-93-5](https://api.angenesci.com/structure/3063/19794-93-5.png)
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| CAS Number | 19794-93-5 |
| Catalog Number | AG002B6W(AGN-PC-0QPH08) |
| Chemical Name | 1,2,4-Triazolo[4,3-a]pyridin-3(2H)-one, 2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]- |
| EC Number | 243-317-1 |
| IUPAC Name | 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one |
| InChI | InChI=1S/C19H22ClN5O/c20-16-5-3-6-17(15-16)23-13-11-22(12-14-23)8-4-10-25-19(26)24-9-2-1-7-18(24)21-25/h1-3,5-7,9,15H,4,8,10-14H2 |
| InChI Key | PHLBKPHSAVXXEF-UHFFFAOYSA-N |
| MDL Number | MFCD00242886 |
| Molecular Formula | C19H22ClN5O |
| Molecular Weight | 371.8639 |
| SMILES | ClC=1C=C(C=CC1)N1CCN(CC1)CCCN1N=C2N(C=CC=C2)C1=O |
| UNII | YBK48BXK30 |
| Synonyms | AF 1161,
AF-1161,
AF1161,
Apo Trazodone,
Apo-Trazodone,
Deprax,
Desyrel,
Gen Trazodone,
Gen-Trazodone,
Molipaxin,
Novo Trazodone,
Novo-Trazodone,
Nu Trazodone,
Nu-Trazodone,
PMS Trazodone,
PMS-Trazodone,
ratio Trazodone,
ratio-Trazodone,
RatioTrazodone,
Thombran,
Tradozone,
Trazodon Hexal,
Trazodon neuraxpharm,
Trazodon-neuraxpharm,
Trazodone,
Trazodone Hydrochloride,
TrazodonNeuraxpharm,
Trazon,
Trittico,
trazodone,
Trazodon,
19794-93-5,
Trazodonum,
Beneficat,
Desirel,
Sideril,
Trazalon,
Trazodil,
Trazodona,
Trazonil,
Trialodine,
Desyrel,
Trazodonum [INN-Latin],
Trazodona [INN-Spanish],
Trazodonum [Latin],
Trazodona [Spanish],
Trazodone [INN:BAN],
Molipaxin,
Trittico,
UNII-YBK48BXK30,
C19H22ClN5O,
Trazolan,
Desyrel Dividose,
EINECS 243-317-1,
CHEMBL621,
BRN 0628010,
YBK48BXK30,
CHEBI:9654,
PHLBKPHSAVXXEF-UHFFFAOYSA-N,
Oleptro,
1,2,4-Triazolo(4,3-a)pyridin-3(2H)-one, 2-(3-(4-(3-chlorophenyl)-1-piperazinyl)propyl)-,
2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one,
2-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one,
s-Triazolo(4,3-a)pyridin-3(2H)-one, 2-(3-(4-(m-chlorophenyl)-1-piperazinyl)propyl)-,
Tradozone,
1,2,4-Triazolo[4,3-a]pyridin-3(2H)-one, 2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-,
2-(3-(4-(3-Chlorophenyl)piperazin-1-yl)propyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one,
HSDB 7048,
Trazodone (INN),
Trittico (TN),
trazodone (Desyrel),
NCGC00016035-02,
CAS-25332-39-2,
Spectrum_001424,
Prestwick0_000292,
Prestwick1_000292,
Prestwick2_000292,
Prestwick3_000292,
Spectrum2_000854,
Spectrum3_001560,
Spectrum4_000755,
Spectrum5_000974,
Lopac-T-6154,
EC 243-317-1,
AC1L1KK2,
Lopac0_001159,
Oprea1_185901,
SCHEMBL28167,
BSPBio_000224,
BSPBio_003040,
GTPL213,
KBioGR_001110,
KBioSS_001904,
DivK1c_000196,
SPBio_000867,
SPBio_002443,
BPBio1_000248,
DTXSID5045043,
CTK4E2359,
KBio1_000196,
KBio2_001904,
KBio2_004472,
KBio2_007040,
KBio3_002540,
NINDS_000196,
ZINC538483,
BCP07176,
BDBM50073444,
BG0346,
AKOS015896423,
AC-6778,
AN-9679,
API0000873,
CCG-205233,
DB00656,
MCULE-8110542411,
2-(3-[4-(3-Chlorophenyl)-1-piperazinyl]propyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one,
2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-[1,2,4]triazolo[4,5-a]pyridin-3-one,
IDI1_000196,
NCGC00016035-01,
NCGC00016035-03,
NCGC00016035-04,
NCGC00016035-05,
NCGC00016035-06,
NCGC00016035-07,
NCGC00016035-08,
NCGC00016035-09,
NCGC00016035-10,
NCGC00016035-12,
NCGC00024405-03,
8-[3-[4-(3-Chlorophenyl)piperazin-1-yl]propyl]-1,7,8-triazabicyclo[4.3.0]nona-2,4,6-trien-9-one hydrochloride,
AJ-23398,
BC209162,
M979,
SC-77266,
SBI-0051126.P003,
AX8215176,
LS-156735,
FT-0658382,
C07156,
D08626,
AB00053648-14,
AB00053648_15,
AB00053648_16,
794T935,
L000771,
I06-1977,
BRD-K70778732-003-05-1,
BRD-K70778732-003-15-0,
I14-31859,
1,2,4-Triazolo[4,3-a]pyridin-3(2H)-one,2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-,
2-(3-[4-(3-Chlorophenyl)-1-piperazinyl]propyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one #,
2-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-3-one,
8-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-6,8,9-triazabicyclo[4.3.0]nona-2,4,9-trien-7-one,
Trazodone hydrochloride,
Trazodone Hcl,
Pragmazone,
Thombran,
Bimaran,
Tombran,
Trazon,
Trialodine (TN),
Beneficat (TN),
Molipaxin (TN),
Thombran (TN),
Trazorel (TN),
Desirel (TN),
Desyrel (TN),
Deprax (TN),
D00USF,
Desyrel(trazodone hcl salt),
C19-H22-Cl-N5-O,
CID5533,
ACN-041319,
AF-1161,
25332-39-2,
2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-1,2,4-triazolo[4,3-a]pyridin-3(2h)-one,
s-triazolo [4,3-a] piridin-3 (2H)-ona, 2-[3-[4-(m-clorofenil)-1-piperazinil] propil],
s-Triazolo[4,3-a]pyridin-3(2H)-one, 2-[3-[4-(m-chlorophenyl)-1-piperazinyl]propyl]-,
s-Triazolo[43-a]pyridin-3(2H)-one 2-[3-[4-(m-chlorophenyl)-1-piperazinyl]propyl]-(8CI),
1,2,4-triazolo [4,3-a] piridin-3 (2H)-ona, 2-[3-[4-(3-clorofenil)-1-piperazinil] propil]-,
|
| Complexity | 611 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 371.151g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 371.869g/mol |
| Monoisotopic Mass | 371.151g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 42.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
| Symbol: | |
| Hazard Class | \N |
| Hazard statements | H302 |
| Packing Group | \N |
| Precautionary statements | P280-P305+P351+P338 |
| UN Code | \N |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
| Quantity: |
| Test: | Result: |

