3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide
TL;DR: 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide (CAS 326902-87-8) is a chemical compound with molecular formula C18H14ClN3O5 and molecular weight 387.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-N-(2-methoxy-5-nitrophenyl)-5-methyl-1,2-oxazole-4-carboxamide
Also Known As: 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide, 3-(2-chlorophenyl)-N-(2-methoxy-5-nitrophenyl)-5-methyl-1,2-oxazole-4-carboxamide, A2197/0092461, 3-(2-chlorophenyl)-N-(2-methoxy-5-nitrophenyl)-5-methylisoxazole-4-carboxamide, [3-(2-chlorophenyl)-5-methylisoxazol-4-yl]-N-(2-methoxy-5-nitrophenyl)carboxam ide
| Molecular Formula | C18H14ClN3O5 |
|---|---|
| Molecular Weight | 387.06 g/mol |
| LogP | 4.47252 |
| Topological Polar Surface Area | 107.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.0622 |
| Heavy Atoms | 27 |
| Complexity | 1031.5867 |
Chemical Identifiers
| CAS Number | 326902-87-8 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC |
Product Overview
3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide (CAS 326902-87-8), with molecular formula C18H14ClN3O5 and molecular weight 387.06 g/mol. IUPAC: 3-(2-chlorophenyl)-N-(2-methoxy-5-nitrophenyl)-5-methyl-1,2-oxazole-4-carboxamide.
Chemical Property Profile of 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide
Property Insights of 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide
The XLogP value of 4.47252 indicates that 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-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-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide. Following Lipinski's Rule of Five, 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-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-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide?
The CAS number of 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide is 326902-87-8.
What is the molecular formula of 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide?
The molecular formula of 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide is C18H14ClN3O5.
What is the molecular weight of 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide?
The molecular weight of 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide is 387.06 g/mol.
Where can I buy 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide?
You can request a quote for 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-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-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-chlorophenyl)-N-{5-nitro-2-methoxyphenyl}-5-methyl-4-isoxazolecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.