Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate
TL;DR: Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate (CAS 333779-17-2) 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.
methyl 2-benzamido-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: BAS 03303081, methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate, methyl 2-benzamido-4-methyl-1,3-thiazole-5-carboxylate, 2-Benzoylamino-4-methyl-thiazole-5-carboxylic acid methyl ester, methyl 2-(benzoylamino)-4-methyl-1,3-thiazole-5-carboxylate
| Molecular Formula | C13H12N2O3S |
|---|---|
| Molecular Weight | 276.06 g/mol |
| LogP | 2.49042 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.05685 |
| Heavy Atoms | 19 |
| Complexity | 607.60583 |
Chemical Identifiers
| CAS Number | 333779-17-2 |
|---|---|
| SMILES | CC1=C(SC(=N1)NC(=O)C2=CC=CC=C2)C(=O)OC |
Product Overview
Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate (CAS 333779-17-2), with molecular formula C13H12N2O3S and molecular weight 276.06 g/mol. IUPAC: methyl 2-benzamido-4-methyl-1,3-thiazole-5-carboxylate.
Chemical Property Profile of Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate
Property Insights of Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate
The XLogP value of 2.49042 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate. Following Lipinski's Rule of Five, Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate 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 Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate?
The CAS number of Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate is 333779-17-2.
What is the molecular formula of Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate?
The molecular formula of Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate is C13H12N2O3S.
What is the molecular weight of Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate?
The molecular weight of Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate is 276.06 g/mol.
Where can I buy Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate?
You can request a quote for Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-methyl-2-[(phenylcarbonyl)amino]-1,3-thiazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.