3-(Quinazolin-4-ylthio)propanoic acid
TL;DR: 3-(Quinazolin-4-ylthio)propanoic acid (CAS 14068-40-7) is a chemical compound with molecular formula C11H10N2O2S and molecular weight 234.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-quinazolin-4-ylsulfanylpropanoic acid
Also Known As: 3-(Quinazolin-4-ylthio)propanoic acid, 3-(quinazolin-4-ylsulfanyl)propanoic acid, 3-quinazolin-4-ylsulfanylpropanoic acid, 3-quinazolin-4-ylthiopropanoic acid, 3-(Quinazolin-4-ylthio)propanoicacid
| Molecular Formula | C11H10N2O2S |
|---|---|
| Molecular Weight | 234.05 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 88.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.0463 |
| Heavy Atoms | 16 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 14068-40-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NC=N2)SCCC(=O)O |
| InChIKey | WQTFNWOAHQIRIR-UHFFFAOYSA-N |
Product Overview
3-(Quinazolin-4-ylthio)propanoic acid (CAS 14068-40-7), with molecular formula C11H10N2O2S and molecular weight 234.05 g/mol. IUPAC: 3-quinazolin-4-ylsulfanylpropanoic acid.
Chemical Property Profile of 3-(Quinazolin-4-ylthio)propanoic acid
Property Insights of 3-(Quinazolin-4-ylthio)propanoic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Quinazolin-4-ylthio)propanoic acid. The TPSA of 88.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Quinazolin-4-ylthio)propanoic acid. Following Lipinski's Rule of Five, 3-(Quinazolin-4-ylthio)propanoic acid has 1 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 3-(Quinazolin-4-ylthio)propanoic acid?
The CAS number of 3-(Quinazolin-4-ylthio)propanoic acid is 14068-40-7.
What is the molecular formula of 3-(Quinazolin-4-ylthio)propanoic acid?
The molecular formula of 3-(Quinazolin-4-ylthio)propanoic acid is C11H10N2O2S.
What is the molecular weight of 3-(Quinazolin-4-ylthio)propanoic acid?
The molecular weight of 3-(Quinazolin-4-ylthio)propanoic acid is 234.05 g/mol.
Where can I buy 3-(Quinazolin-4-ylthio)propanoic acid?
You can request a quote for 3-(Quinazolin-4-ylthio)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Quinazolin-4-ylthio)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Quinazolin-4-ylthio)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.