4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo-
TL;DR: 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo- (CAS 74332-99-3) is a chemical compound with molecular formula C12H12N2O3S and molecular weight 264.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-prop-2-enyl-2-sulfanylidene-1,4-dihydroquinazoline-4-carboperoxoic acid
Also Known As: 2-Mercapto-3-allyl-4-carboxy-4-hydroxy-3,4-dihydroquinazoline, 5-25-09-00024 (Beilstein Handbook Reference), 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo-, 3-Allyl-4-hydroxy-1,2,3,4-tetrahydro-2-thioxo-4-quinazolinecarboxylic acid, 3-(Prop-2-en-1-yl)-2-sulfanyl-3,4-dihydroquinazoline-4-carboperoxoic acid
| Molecular Formula | C12H12N2O3S |
|---|---|
| Molecular Weight | 264.06 g/mol |
| LogP | 1.9423 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.05685 |
| Heavy Atoms | 18 |
| Complexity | 503.85083 |
Chemical Identifiers
| CAS Number | 74332-99-3 |
|---|---|
| SMILES | C=CCN1C(C2=CC=CC=C2NC1=S)C(=O)OO |
Product Overview
4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo- (CAS 74332-99-3), with molecular formula C12H12N2O3S and molecular weight 264.06 g/mol. IUPAC: 3-prop-2-enyl-2-sulfanylidene-1,4-dihydroquinazoline-4-carboperoxoic acid.
Chemical Property Profile of 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo-
Property Insights of 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo-
The XLogP value of 1.9423 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo-. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo-. Following Lipinski's Rule of Five, 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo- 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 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo-?
The CAS number of 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo- is 74332-99-3.
What is the molecular formula of 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo-?
The molecular formula of 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo- is C12H12N2O3S.
What is the molecular weight of 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo-?
The molecular weight of 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo- is 264.06 g/mol.
Where can I buy 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo-?
You can request a quote for 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for 4-Quinazolinecarboxylic acid, 1,2,3,4-tetrahydro-3-allyl-4-hydroxy-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.