3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide
TL;DR: 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide (CAS 600128-58-3) is a chemical compound with molecular formula C15H15N3O5S and molecular weight 349.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-nitro-N-[(4-sulfamoylphenyl)methyl]benzamide
Also Known As: 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide, 3-methyl-2-nitro-N-[(4-sulfamoylphenyl)methyl]benzamide, N-[4-(aminosulfonyl)benzyl]-3-methyl-2-nitrobenzamide, (3-methyl-2-nitrophenyl)-N-[(4-sulfamoylphenyl)methyl]carboxamide
| Molecular Formula | C15H15N3O5S |
|---|---|
| Molecular Weight | 349.07 g/mol |
| LogP | 1.48062 |
| Topological Polar Surface Area | 132.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.07324 |
| Heavy Atoms | 24 |
| Complexity | 891.82556 |
Chemical Identifiers
| CAS Number | 600128-58-3 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-] |
Product Overview
3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide (CAS 600128-58-3), with molecular formula C15H15N3O5S and molecular weight 349.07 g/mol. IUPAC: 3-methyl-2-nitro-N-[(4-sulfamoylphenyl)methyl]benzamide.
Chemical Property Profile of 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide
Property Insights of 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide
The XLogP value of 1.48062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide. The TPSA of 132.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide. Following Lipinski's Rule of Five, 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide 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 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide?
The CAS number of 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide is 600128-58-3.
What is the molecular formula of 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide?
The molecular formula of 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide is C15H15N3O5S.
What is the molecular weight of 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide?
The molecular weight of 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide is 349.07 g/mol.
Where can I buy 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide?
You can request a quote for 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-2-nitro-N-(4-sulfamoylbenzyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.