8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-
TL;DR: 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)- (CAS 226906-68-9) is a chemical compound with molecular formula C15H17N5OS and molecular weight 315.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-9-benzyl-2-propylsulfanyl-7H-purin-8-one
Also Known As: 9-benzyl-8-hydroxy-2-propylthioadenine, 6-amino-9-benzyl-2-propylsulfanyl-7H-purin-8-one, 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-, 6-Amino-9-benzyl-2-(propylthio)-7H-purin-8(9H)-one, 6-Amino-9-benzyl-2-(propylsulfanyl)-7,9-dihydro-8H-purin-8-one
| Molecular Formula | C15H17N5OS |
|---|---|
| Molecular Weight | 315.12 g/mol |
| LogP | 2.2522 |
| Topological Polar Surface Area | 89.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.1154 |
| Heavy Atoms | 22 |
| Complexity | 840.25525 |
Chemical Identifiers
| CAS Number | 226906-68-9 |
|---|---|
| SMILES | CCCSC1=NC(=C2C(=N1)N(C(=O)N2)CC3=CC=CC=C3)N |
Product Overview
8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)- (CAS 226906-68-9), with molecular formula C15H17N5OS and molecular weight 315.12 g/mol. IUPAC: 6-amino-9-benzyl-2-propylsulfanyl-7H-purin-8-one.
Chemical Property Profile of 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-
Property Insights of 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-
The XLogP value of 2.2522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-. The TPSA of 89.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-. Following Lipinski's Rule of Five, 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)- has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-?
The CAS number of 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)- is 226906-68-9.
What is the molecular formula of 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-?
The molecular formula of 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)- is C15H17N5OS.
What is the molecular weight of 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-?
The molecular weight of 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)- is 315.12 g/mol.
Where can I buy 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-?
You can request a quote for 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.