4-({5-[6-(Benzylsulfanyl)-9h-purin-9-yl]pentanoyl}amino)-2-hydroxybenzoic acid structure

4-({5-[6-(Benzylsulfanyl)-9h-purin-9-yl]pentanoyl}amino)-2-hydroxybenzoic acid

4-[5-(6-benzylsulfanylpurin-9-yl)pentanoylamino]-2-hydroxybenzoic acid

Also Known As: 4-({5-[6-(benzylsulfanyl)-9h-purin-9-yl]pentanoyl}amino)-2-hydroxybenzoic acid|4-[5-(6-benzylsulfanylpurin-9-yl)pentanoylamino]-2-hydroxybenzoic acid|4-(5-(6-(Benzylthio)-9H-purin-9-yl)pentanamido)-2-hydroxybenzoic acid|4-{5-[6-(Benzylsulfanyl)-9H-purin-9-yl]pentanamido}-2-hydroxybenzoic acid

CAS: 4472-02-0
Molecular Formula C24H23N5O4S
Molecular Weight 477.14706 g/mol
LogP 3.6
Topological Polar Surface Area 156.0 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 8
Rotatable Bonds 10
Exact Mass 477.14706
Monoisotopic Mass 477.14706
Heavy Atoms 34
Complexity 680.0

Chemical Identifiers

CAS Number 4472-02-0
SMILES C1=CC=C(C=C1)CSC2=NC=NC3=C2N=CN3CCCCC(=O)NC4=CC(=C(C=C4)C(=O)O)O
InChIKey ZKNYGLOBXFZJHA-UHFFFAOYSA-N

Product Overview

4-({5-[6-(Benzylsulfanyl)-9h-purin-9-yl]pentanoyl}amino)-2-hydroxybenzoic acid (CAS 4472-02-0), with molecular formula C24H23N5O4S and molecular weight 477.14706 g/mol. IUPAC: 4-[5-(6-benzylsulfanylpurin-9-yl)pentanoylamino]-2-hydroxybenzoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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4-({5-[6-(Benzylsulfanyl)-9h-purin-9-yl]pentanoyl}amino)-2-hydroxybenzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.

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