![1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea structure](/static/products/906/90642-34-5.png)
1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea
TL;DR: 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea (CAS 90642-34-5) is a chemical compound with molecular formula C9H11N7O2S and molecular weight 281.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea
Also Known As: 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea, N-Methyl-N-nitroso-N'-[2-(6-sulfanylidene-3,6-dihydro-9H-purin-9-yl)ethyl]urea
| Molecular Formula | C9H11N7O2S |
|---|---|
| Molecular Weight | 281.07 g/mol |
| LogP | 0.81169 |
| Topological Polar Surface Area | 108.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.0695 |
| Heavy Atoms | 19 |
| Complexity | 663.877 |
Chemical Identifiers
| CAS Number | 90642-34-5 |
|---|---|
| SMILES | CN(C(=O)NCCN1C=NC2=C1NC=NC2=S)N=O |
Product Overview
1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea (CAS 90642-34-5), with molecular formula C9H11N7O2S and molecular weight 281.07 g/mol. IUPAC: 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea.
Chemical Property Profile of 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea
Property Insights of 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea
The XLogP value of 0.81169 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea. The TPSA of 108.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea. Following Lipinski's Rule of Five, 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea has 2 hydrogen bond donor(s) and 6 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 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea?
The CAS number of 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea is 90642-34-5.
What is the molecular formula of 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea?
The molecular formula of 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea is C9H11N7O2S.
What is the molecular weight of 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea?
The molecular weight of 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea is 281.07 g/mol.
Where can I buy 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea?
You can request a quote for 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.