3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide
TL;DR: 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide (CAS 313392-49-3) is a chemical compound with molecular formula C19H16ClN3O5 and molecular weight 401.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-1,2-oxazole-4-carboxamide
Also Known As: BIM-0031001.P001, 3-(2-chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-1,2-oxazole-4-carboxamide, 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide, [3-(2-chlorophenyl)-5-methylisoxazol-4-yl]-N-(4-ethoxy-2-nitrophenyl)carboxami de, 3-(2-CHLOROPHENYL)-N-(4-ETHOXY-2-NITROPHENYL)-5-METHYL-12-OXAZOLE-4-CARBOXAMIDE
| Molecular Formula | C19H16ClN3O5 |
|---|---|
| Molecular Weight | 401.08 g/mol |
| LogP | 4.86262 |
| Topological Polar Surface Area | 107.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.07785 |
| Heavy Atoms | 28 |
| Complexity | 1047.7985 |
Chemical Identifiers
| CAS Number | 313392-49-3 |
|---|---|
| SMILES | CCOC1=CC(=C(C=C1)NC(=O)C2=C(ON=C2C3=CC=CC=C3Cl)C)[N+](=O)[O-] |
Product Overview
3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide (CAS 313392-49-3), with molecular formula C19H16ClN3O5 and molecular weight 401.08 g/mol. IUPAC: 3-(2-chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-1,2-oxazole-4-carboxamide.
Chemical Property Profile of 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide
Property Insights of 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide
The XLogP value of 4.86262 indicates that 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide. Following Lipinski's Rule of Five, 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide has 1 hydrogen bond donor(s) and 6 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 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide?
The CAS number of 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide is 313392-49-3.
What is the molecular formula of 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide?
The molecular formula of 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide is C19H16ClN3O5.
What is the molecular weight of 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide?
The molecular weight of 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide is 401.08 g/mol.
Where can I buy 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide?
You can request a quote for 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Chlorophenyl)-N-(4-ethoxy-2-nitrophenyl)-5-methyl-4-isoxazolecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.