![3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide structure](/static/products/4449/444933-23-7.webp)
3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide
TL;DR: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide (CAS 444933-23-7) is a chemical compound with molecular formula C20H12ClFN4O4S and molecular weight 458.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide
Also Known As: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide, [3-(2-chloro-6-fluorophenyl)-5-methylisoxazol-4-yl]-N-[4-(3-nitrophenyl)(1,3-t hiazol-2-yl)]carboxamide, 3-(2-chloro-6-fluorophenyl)-N-(4-{3-nitrophenyl}-1,3-thiazol-2-yl)-5-methyl-4-isoxazolecarboxamide
| Molecular Formula | C20H12ClFN4O4S |
|---|---|
| Molecular Weight | 458.03 g/mol |
| LogP | 5.72652 |
| Topological Polar Surface Area | 111.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 458.02518 |
| Heavy Atoms | 31 |
| Complexity | 1300.0145 |
Chemical Identifiers
| CAS Number | 444933-23-7 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide (CAS 444933-23-7), with molecular formula C20H12ClFN4O4S and molecular weight 458.03 g/mol. IUPAC: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide.
Chemical Property Profile of 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide
Property Insights of 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide
The XLogP value of 5.72652 indicates that 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide. Following Lipinski's Rule of Five, 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide?
The CAS number of 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide is 444933-23-7.
What is the molecular formula of 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide?
The molecular formula of 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide is C20H12ClFN4O4S.
What is the molecular weight of 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide?
The molecular weight of 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide is 458.03 g/mol.
Where can I buy 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide?
You can request a quote for 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-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 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.