Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate
TL;DR: Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate (CAS 403721-83-5) is a chemical compound with molecular formula C10H9N3O3S and molecular weight 251.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate
Also Known As: Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate, N-(4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)methoxyformamide, F0912-2561, methyl (4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)carbamate, methyl 4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-ylcarbamate
| Molecular Formula | C10H9N3O3S |
|---|---|
| Molecular Weight | 251.04 g/mol |
| LogP | 1.36899 |
| Topological Polar Surface Area | 76.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 251.03647 |
| Heavy Atoms | 17 |
| Complexity | 688.99097 |
Chemical Identifiers
| CAS Number | 403721-83-5 |
|---|---|
| SMILES | COC(=O)NN1C(=O)C2=CC=CC=C2NC1=S |
Product Overview
Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate (CAS 403721-83-5), with molecular formula C10H9N3O3S and molecular weight 251.04 g/mol. IUPAC: methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate.
Chemical Property Profile of Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate
Property Insights of Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate
The XLogP value of 1.36899 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate. The TPSA of 76.12 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate. Following Lipinski's Rule of Five, Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate has 2 hydrogen bond donor(s) and 4 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 Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate?
The CAS number of Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate is 403721-83-5.
What is the molecular formula of Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate?
The molecular formula of Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate is C10H9N3O3S.
What is the molecular weight of Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate?
The molecular weight of Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate is 251.04 g/mol.
Where can I buy Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate?
You can request a quote for Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Methyl N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.