N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
TL;DR: N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide (CAS 445003-56-5) is a chemical compound with molecular formula C19H17ClFN3O3S and molecular weight 421.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
Also Known As: N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide, 2-{[3-(2-chloro-6-fluorophenyl)-5-methylisoxazol-4-yl]carbonylamino}-4-ethyl-5 -methylthiophene-3-carboxamide, N-[3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienyl]-3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxamide
| Molecular Formula | C19H17ClFN3O3S |
|---|---|
| Molecular Weight | 421.07 g/mol |
| LogP | 4.72604 |
| Topological Polar Surface Area | 98.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.0663 |
| Heavy Atoms | 28 |
| Complexity | 1070.2771 |
Chemical Identifiers
| CAS Number | 445003-56-5 |
|---|---|
| SMILES | CCC1=C(SC(=C1C(=O)N)NC(=O)C2=C(ON=C2C3=C(C=CC=C3Cl)F)C)C |
Product Overview
N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide (CAS 445003-56-5), with molecular formula C19H17ClFN3O3S and molecular weight 421.07 g/mol. IUPAC: N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide.
Chemical Property Profile of N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
Property Insights of N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
The XLogP value of 4.72604 indicates that N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.22 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide. Following Lipinski's Rule of Five, N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide 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 N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide?
The CAS number of N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide is 445003-56-5.
What is the molecular formula of N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide?
The molecular formula of N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide is C19H17ClFN3O3S.
What is the molecular weight of N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide?
The molecular weight of N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide is 421.07 g/mol.
Where can I buy N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide?
You can request a quote for N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.