S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate
TL;DR: S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate (CAS 364383-22-2) is a chemical compound with molecular formula C12H12N2O2S and molecular weight 248.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate
Also Known As: S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate, 6-METHOXY-4-METHYL-2-QUINAZOLINYL ETHANETHIOATE
| Molecular Formula | C12H12N2O2S |
|---|---|
| Molecular Weight | 248.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.06195 |
| Heavy Atoms | 17 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 364383-22-2 |
|---|---|
| SMILES | CC1=C2C=C(C=CC2=NC(=N1)SC(=O)C)OC |
| InChIKey | OOGQAWAGWHITIV-UHFFFAOYSA-N |
Product Overview
S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate (CAS 364383-22-2), with molecular formula C12H12N2O2S and molecular weight 248.06 g/mol. IUPAC: S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate.
Chemical Property Profile of S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate
Property Insights of S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate. Following Lipinski's Rule of Five, S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate has 0 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 S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate?
The CAS number of S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate is 364383-22-2.
What is the molecular formula of S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate?
The molecular formula of S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate is C12H12N2O2S.
What is the molecular weight of S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate?
The molecular weight of S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate is 248.06 g/mol.
Where can I buy S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate?
You can request a quote for S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate?
Yes, KEHONG BIO provides custom synthesis services for S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.