4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester
TL;DR: 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester (CAS 886497-90-1) is a chemical compound with molecular formula C14H15NO3S and molecular weight 277.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(3,4-dimethylphenyl)-2-oxo-3H-1,3-thiazole-5-carboxylate
Also Known As: 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester, Ethyl 4-(3,4-dimethylphenyl)-2-oxo-2,3-dihydrothiazole-5-carboxylate, ethyl 4-(3,4-dimethylphenyl)-2-oxo-3H-1,3-thiazole-5-carboxylate, Ethyl 4-(3,4-dimethylphenyl)-2-oxo-2,3-dihydro-1,3-thiazole-5-carboxylate, ethyl 4-(3,4-dimethylphenyl)-2-oxo-3H-thiazole-5-carboxylate
| Molecular Formula | C14H15NO3S |
|---|---|
| Molecular Weight | 277.08 g/mol |
| LogP | 2.89694 |
| Topological Polar Surface Area | 59.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.07727 |
| Heavy Atoms | 19 |
| Complexity | 669.57086 |
Chemical Identifiers
| CAS Number | 886497-90-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=O)S1)C2=CC(=C(C=C2)C)C |
Product Overview
4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester (CAS 886497-90-1), with molecular formula C14H15NO3S and molecular weight 277.08 g/mol. IUPAC: ethyl 4-(3,4-dimethylphenyl)-2-oxo-3H-1,3-thiazole-5-carboxylate.
Chemical Property Profile of 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester
Property Insights of 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester
The XLogP value of 2.89694 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester. With a topological polar surface area (TPSA) of 59.16 Ų, 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester 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-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester?
The CAS number of 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester is 886497-90-1.
What is the molecular formula of 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester?
The molecular formula of 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester is C14H15NO3S.
What is the molecular weight of 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester?
The molecular weight of 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester is 277.08 g/mol.
Where can I buy 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester?
You can request a quote for 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,4-Dimethyl-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.