Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester
TL;DR: Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester (CAS 3607-22-5) is a chemical compound with molecular formula C13H12N2O3S and molecular weight 276.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-1-phenyl-2-(1,3-thiazol-2-ylamino)ethyl] acetate
Also Known As: ChemDiv2_004850, IDI1_003565, BAS 05289075, Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester, 2-oxo-1-phenyl-2-(1,3-thiazol-2-ylamino)ethyl acetate
| Molecular Formula | C13H12N2O3S |
|---|---|
| Molecular Weight | 276.06 g/mol |
| LogP | 2.386 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.05685 |
| Heavy Atoms | 19 |
| Complexity | 554.532 |
Chemical Identifiers
| CAS Number | 3607-22-5 |
|---|---|
| SMILES | CC(=O)OC(C1=CC=CC=C1)C(=O)NC2=NC=CS2 |
Product Overview
Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester (CAS 3607-22-5), with molecular formula C13H12N2O3S and molecular weight 276.06 g/mol. IUPAC: [2-oxo-1-phenyl-2-(1,3-thiazol-2-ylamino)ethyl] acetate.
Chemical Property Profile of Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester
Property Insights of Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester
The XLogP value of 2.386 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester. Following Lipinski's Rule of Five, Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester 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 Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester?
The CAS number of Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester is 3607-22-5.
What is the molecular formula of Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester?
The molecular formula of Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester is C13H12N2O3S.
What is the molecular weight of Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester?
The molecular weight of Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester is 276.06 g/mol.
Where can I buy Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester?
You can request a quote for Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid phenyl-(thiazol-2-ylcarbamoyl)-methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.