Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)-
TL;DR: Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)- (CAS 49779-96-6) is a chemical compound with molecular formula C13H11ClN2O3S and molecular weight 310.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-acetamido-4-(4-chlorophenyl)-1,3-thiazol-5-yl]acetic acid
Also Known As: KAAT, 2-4- thiazole-5-aceticacid, 2- -4- thiazole-5-aceticacid, Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)-, 2-Acetylamino-4-p-chlorophenylthiazole-5-acetic acid
| Molecular Formula | C13H11ClN2O3S |
|---|---|
| Molecular Weight | 310.02 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.01788 |
| Heavy Atoms | 20 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 49779-96-6 |
|---|---|
| SMILES | CC(=O)NC1=NC(=C(S1)CC(=O)O)C2=CC=C(C=C2)Cl |
| InChIKey | WRDDUWAOAXNARV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)- (CAS 49779-96-6), with molecular formula C13H11ClN2O3S and molecular weight 310.02 g/mol. IUPAC: 2-[2-acetamido-4-(4-chlorophenyl)-1,3-thiazol-5-yl]acetic acid.
Chemical Property Profile of Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)-
Property Insights of Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)-. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)-. Following Lipinski's Rule of Five, Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)- has 2 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 Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)-?
The CAS number of Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)- is 49779-96-6.
What is the molecular formula of Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)-?
The molecular formula of Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)- is C13H11ClN2O3S.
What is the molecular weight of Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)-?
The molecular weight of Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)- is 310.02 g/mol.
Where can I buy Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)-?
You can request a quote for Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Thiazole-5-acetic acid, 2-acetamido-4-(p-chlorophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.