AG000JF4

1227633-49-9 | Phenol, 4-[2-[[2-benzo[b]thien-3-yl-9-(1-methylethyl)-9H-purin-6-yl]amino]ethyl]-

AG000JF4

SDS

COA

TIP This product is typically in stock.Please contact us for quotation.

Request For Quotation

• mg
• g
• kg
• ml
• L

No data

• mg
• g
• kg
• ml
• L

No data

No data

Inquire

CAS Number	1227633-49-9
Catalog Number	AG000JF4(AGN-PC-0WAMJA)
Chemical Name	Phenol, 4-[2-[[2-benzo[b]thien-3-yl-9-(1-methylethyl)-9H-purin-6-yl]amino]ethyl]-
IUPAC Name	4-[2-[[2-(1-benzothiophen-3-yl)-9-propan-2-ylpurin-6-yl]amino]ethyl]phenol
InChI	InChI=1S/C24H23N5OS/c1-15(2)29-14-26-21-23(25-12-11-16-7-9-17(30)10-8-16)27-22(28-24(21)29)19-13-31-20-6-4-3-5-18(19)20/h3-10,13-15,30H,11-12H2,1-2H3,(H,25,27,28)
InChI Key	BGFHMYJZJZLMHW-UHFFFAOYSA-N
MDL Number	MFCD16987861
Molecular Formula	C24H23N5OS
Molecular Weight	429.5373
SMILES	CC(N1C=NC2=C(N=C(N=C21)C3=CSC4=C3C=CC=C4)NCCC5=CC=C(C=C5)O)C
Synonyms	StemRegenin 1, StemRegenin 1, 1227633-49-9, StemRegenin 1 (SR1), 4-(2-(2-(benzo[b]thiophen-3-yl)-9-isopropyl-9H-purin-6-ylamino)ethyl)phenol, Etmregenin 1, SetmEegenin 1, C24H23N5OS, StemRegenin1, stemRegenin-1, SetmRegenin 1, BGFHMYJZJZLMHW-UHFFFAOYSA-N, StemRegenin 1(SR-1), MLS006011183, SCHEMBL2314094, AOB2652, DTXSID70673068, EX-A226, HMS3651H19, BCP07738, 2730AH, MFCD16987861, s2858, ZINC86014468, AKOS026750225, ACN-029549, CS-1643, QC-8225, NCGC00263553-02, NCGC00263553-13, 4CA-0513, AK340951, AS-16725, BC600356, HY-15001, SMR004702952, AB0097171, FT-0700430, SW218198-2, A12945, SR-01000650021, J-690075, SR-01000650021-1, 4-(2-((2-(benzo[b]thiophen-3-yl)-9-isopropyl-9H-purin-6-yl)amino)ethyl)phenol, 4-(2-(2-(benzo[b]thiophen-3-yl)-9-isopropyl-9H-purin-6-ylamino)ethyl)phenol, AldrichCPR, 4-(2-{[2-(1-Benzothiophen-3-yl)-9-(propan-2-yl)-9H-purin-6-yl]amino}ethyl)phenol, 4-[2-[[2-(1-benzothiophen-3-yl)-9-propan-2-ylpurin-6-yl]amino]ethyl]phenol, Phenol, 4-[2-[[2-benzo[b]thien-3-yl-9-(1-methylethyl)-9H-purin-6-yl]amino]ethyl]-, (1R,2S)-2-Cyclohexyl-1-[4-(cyclopropylsulfonyl)phenyl]-N-(5-{[2-(1-pyrrolidinyl)ethyl]sulfanyl}-1,3-thiazol-2-yl)cyclopropanecarboxa mide, SR-1, A8224, C552240, SR1, SR-1; 4-(2-(2-(benzo[b]thiophen-3-yl)-9-isopropyl-9H-purin-6-ylamino)ethyl)phenol,

Complexity	586
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	429.162g/mol
Formal Charge	0
Heavy Atom Count	31
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	429.542g/mol
Monoisotopic Mass	429.162g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	104A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number