3-iodo-4-methyl-N-(4-nitrophenyl)benzamide
TL;DR: 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide (CAS 497089-64-2) is a chemical compound with molecular formula C14H11IN2O3 and molecular weight 381.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-iodo-4-methyl-N-(4-nitrophenyl)benzamide
Also Known As: 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide, N-{4-nitrophenyl}-3-iodo-4-methylbenzamide, AN-329/41437744, (3-iodo-4-methylphenyl)-N-(4-nitrophenyl)carboxamide
| Molecular Formula | C14H11IN2O3 |
|---|---|
| Molecular Weight | 381.98 g/mol |
| LogP | 3.76012 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.98145 |
| Heavy Atoms | 20 |
| Complexity | 668.61926 |
Chemical Identifiers
| CAS Number | 497089-64-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])I |
Product Overview
3-iodo-4-methyl-N-(4-nitrophenyl)benzamide (CAS 497089-64-2), with molecular formula C14H11IN2O3 and molecular weight 381.98 g/mol. IUPAC: 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide.
Chemical Property Profile of 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide
Property Insights of 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide
The XLogP value of 3.76012 indicates that 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide. Following Lipinski's Rule of Five, 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide has 1 hydrogen bond donor(s) and 3 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-iodo-4-methyl-N-(4-nitrophenyl)benzamide?
The CAS number of 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide is 497089-64-2.
What is the molecular formula of 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide?
The molecular formula of 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide is C14H11IN2O3.
What is the molecular weight of 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide?
The molecular weight of 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide is 381.98 g/mol.
Where can I buy 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide?
You can request a quote for 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-iodo-4-methyl-N-(4-nitrophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.