2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid
TL;DR: 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid (CAS 886500-86-3) is a chemical compound with molecular formula C13H14N2O5S and molecular weight 310.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6,7-dimethoxy-3-methyl-4-oxoquinazolin-2-yl)sulfanylacetic acid
Also Known As: 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid, (6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydro-quinazolin-2-ylsulfanyl)-acetic acid, 2-(6,7-dimethoxy-3-methyl-4-oxoquinazolin-2-yl)sulfanylacetic acid, 2-[(6,7-dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetic acid, 2-(6,7-dimethoxy-3-methyl-4-oxo-quinazolin-2-yl)sulfanylacetic Acid
| Molecular Formula | C13H14N2O5S |
|---|---|
| Molecular Weight | 310.06 g/mol |
| LogP | 1.1274 |
| Topological Polar Surface Area | 90.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.06235 |
| Heavy Atoms | 21 |
| Complexity | 756.2905 |
Chemical Identifiers
| CAS Number | 886500-86-3 |
|---|---|
| SMILES | CN1C(=O)C2=CC(=C(C=C2N=C1SCC(=O)O)OC)OC |
Product Overview
2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid (CAS 886500-86-3), with molecular formula C13H14N2O5S and molecular weight 310.06 g/mol. IUPAC: 2-(6,7-dimethoxy-3-methyl-4-oxoquinazolin-2-yl)sulfanylacetic acid.
Chemical Property Profile of 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid
Property Insights of 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid
The XLogP value of 1.1274 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid. The TPSA of 90.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid. Following Lipinski's Rule of Five, 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid has 1 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 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid?
The CAS number of 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid is 886500-86-3.
What is the molecular formula of 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid?
The molecular formula of 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid is C13H14N2O5S.
What is the molecular weight of 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid?
The molecular weight of 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid is 310.06 g/mol.
Where can I buy 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid?
You can request a quote for 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-((6,7-Dimethoxy-3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.