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[(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid
TL;DR: [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid (CAS 125416-72-0) is a chemical compound with molecular formula C17H14N2O2S and molecular weight 310.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylquinazolin-2-yl)sulfanyl-2-phenylacetic acid
Also Known As: [(4-methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid|(4-methyl-2-quinazolinylthio)phenylacetic acid|F0213-0024|2-(4-methylquinazolin-2-yl)sulfanyl-2-phenylacetic acid|SR-01000906528-1|(4-Methyl-quinazolin-2-ylsulfanyl)-phenyl-acetic acid|2-(4-methylquinazolin-2-ylthio)-2-phenylacetic acid|Propanedioic acid,diazo-,ethyl 2-oxo-6-heptenyl ester|2-((4-methylquinazolin-2-yl)thio)-2-phenylacetic acid|2-(4-methylquinazolin-2-yl)sulfanyl-2-phenyl-acetic Acid
| Molecular Formula | C17H14N2O2S |
|---|---|
| Molecular Weight | 310.08 g/mol |
| LogP | 3.85622 |
| Topological Polar Surface Area | 63.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.0776 |
| Heavy Atoms | 22 |
| Complexity | 821.2617 |
Chemical Identifiers
| CAS Number | 125416-72-0 |
|---|---|
| SMILES | CC1=NC(=NC2=CC=CC=C12)SC(C3=CC=CC=C3)C(=O)O |
Product Overview
[(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid (CAS 125416-72-0), with molecular formula C17H14N2O2S and molecular weight 310.08 g/mol. IUPAC: 2-(4-methylquinazolin-2-yl)sulfanyl-2-phenylacetic acid.
Chemical Property Profile of [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid
Property Insights of [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid
The XLogP value of 3.85622 indicates that [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.08 Ų falls within the moderate polarity range, balancing permeability and solubility for [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid. Following Lipinski's Rule of Five, [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid has 1 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-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid?
The CAS number of [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid is 125416-72-0.
What is the molecular formula of [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid?
The molecular formula of [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid is C17H14N2O2S.
What is the molecular weight of [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid?
The molecular weight of [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid is 310.08 g/mol.
Where can I buy [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid?
You can request a quote for [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(4-Methylquinazolin-2-yl)sulfanyl](phenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.