![1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea structure](/static/products/4450/445013-38-7.webp)
1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea
TL;DR: 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea (CAS 445013-38-7) is a chemical compound with molecular formula C16H16N4O4 and molecular weight 328.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea
Also Known As: 1-[(4-methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea, 2-{3-nitro-4-methylbenzoyl}-N-(3-methylphenyl)hydrazinecarboxamide, (4-methyl-3-nitrophenyl)-N-{[N-(3-methylphenyl)carbamoyl]amino}carboxamide, 2-[(4-methyl-3-nitrophenyl)carbonyl]-N-(3-methylphenyl)hydrazinecarboxamide
| Molecular Formula | C16H16N4O4 |
|---|---|
| Molecular Weight | 328.12 g/mol |
| LogP | 2.67814 |
| Topological Polar Surface Area | 113.37 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.11716 |
| Heavy Atoms | 24 |
| Complexity | 804.4145 |
Chemical Identifiers
| CAS Number | 445013-38-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)NNC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-] |
Product Overview
1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea (CAS 445013-38-7), with molecular formula C16H16N4O4 and molecular weight 328.12 g/mol. IUPAC: 1-[(4-methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea.
Chemical Property Profile of 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea
Property Insights of 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea
The XLogP value of 2.67814 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea. The TPSA of 113.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea. Following Lipinski's Rule of Five, 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea has 3 hydrogen bond donor(s) and 4 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 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea?
The CAS number of 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea is 445013-38-7.
What is the molecular formula of 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea?
The molecular formula of 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea is C16H16N4O4.
What is the molecular weight of 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea?
The molecular weight of 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea is 328.12 g/mol.
Where can I buy 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea?
You can request a quote for 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Methyl-3-nitrobenzoyl)amino]-3-(3-methylphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.