![8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine structure](/static/products/3104/310421-92-2.webp)
8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine
TL;DR: 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine (CAS 310421-92-2) is a chemical compound with molecular formula C13H10N8O2S and molecular weight 342.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine
Also Known As: BAS 02085096, 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine, 8-(6-Nitro-1H-benzoimidazol-2-ylmethylsulfanyl)-9H-purin-6-ylamine, 8-{[(5-nitro-1H-1,3-benzodiazol-2-yl)methyl]sulfanyl}-7H-purin-6-amine, 8-{[(5-nitro-1H-benzimidazol-2-yl)methyl]sulfanyl}-9H-purin-6-amine
| Molecular Formula | C13H10N8O2S |
|---|---|
| Molecular Weight | 342.06 g/mol |
| LogP | 2.0119 |
| Topological Polar Surface Area | 152.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.06473 |
| Heavy Atoms | 24 |
| Complexity | 1072.4036 |
Chemical Identifiers
| CAS Number | 310421-92-2 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)CSC3=NC4=NC=NC(=C4N3)N |
Product Overview
8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine (CAS 310421-92-2), with molecular formula C13H10N8O2S and molecular weight 342.06 g/mol. IUPAC: 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine.
Chemical Property Profile of 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine
Property Insights of 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine
The XLogP value of 2.0119 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine. The TPSA of 152.3 Ų indicates high polarity, suggesting 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine has 3 hydrogen bond donor(s) and 8 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 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine?
The CAS number of 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine is 310421-92-2.
What is the molecular formula of 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine?
The molecular formula of 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine is C13H10N8O2S.
What is the molecular weight of 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine?
The molecular weight of 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine is 342.06 g/mol.
Where can I buy 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine?
You can request a quote for 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for 8-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-7H-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.