Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate
TL;DR: Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate (CAS 781654-36-2) is a chemical compound with molecular formula C14H13BrN2O3S and molecular weight 367.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3-bromobenzoyl)amino]-4-ethyl-1,3-thiazole-5-carboxylate
Also Known As: VU0509236-1, methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate, F3099-6760, METHYL 2-(3-BROMOBENZAMIDO)-4-ETHYL-1,3-THIAZOLE-5-CARBOXYLATE, methyl 2-[(3-bromobenzoyl)amino]-4-ethyl-1,3-thiazole-5-carboxylate
| Molecular Formula | C14H13BrN2O3S |
|---|---|
| Molecular Weight | 367.98 g/mol |
| LogP | 3.5069 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.98303 |
| Heavy Atoms | 21 |
| Complexity | 684.6087 |
Chemical Identifiers
| CAS Number | 781654-36-2 |
|---|---|
| SMILES | CCC1=C(SC(=N1)NC(=O)C2=CC(=CC=C2)Br)C(=O)OC |
Product Overview
Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate (CAS 781654-36-2), with molecular formula C14H13BrN2O3S and molecular weight 367.98 g/mol. IUPAC: methyl 2-[(3-bromobenzoyl)amino]-4-ethyl-1,3-thiazole-5-carboxylate.
Chemical Property Profile of Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate
Property Insights of Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate
The XLogP value of 3.5069 indicates that Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate. Following Lipinski's Rule of Five, Methyl 2-(3-bromobenzamido)-4-ethylthiazole-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 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate?
The CAS number of Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate is 781654-36-2.
What is the molecular formula of Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate?
The molecular formula of Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate is C14H13BrN2O3S.
What is the molecular weight of Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate?
The molecular weight of Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate is 367.98 g/mol.
Where can I buy Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate?
You can request a quote for Methyl 2-(3-bromobenzamido)-4-ethylthiazole-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 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(3-bromobenzamido)-4-ethylthiazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.