1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea
TL;DR: 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea (CAS 76393-41-4) is a chemical compound with molecular formula C16H17N3O3 and molecular weight 299.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea
Also Known As: 1-(2,4-dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea, 1-(2,4-dimethylphenyl)-3-(4-methyl-3-nitro-phenyl)urea, 668-565-1, RefChem:420523
| Molecular Formula | C16H17N3O3 |
|---|---|
| Molecular Weight | 299.13 g/mol |
| LogP | 4.16406 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.12698 |
| Heavy Atoms | 22 |
| Complexity | 741.4111 |
Chemical Identifiers
| CAS Number | 76393-41-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)NC2=CC(=C(C=C2)C)[N+](=O)[O-])C |
Product Overview
1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea (CAS 76393-41-4), with molecular formula C16H17N3O3 and molecular weight 299.13 g/mol. IUPAC: 1-(2,4-dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea.
Chemical Property Profile of 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea
Property Insights of 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea
The XLogP value of 4.16406 indicates that 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea. Following Lipinski's Rule of Five, 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea has 2 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 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea?
The CAS number of 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea is 76393-41-4.
What is the molecular formula of 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea?
The molecular formula of 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea is C16H17N3O3.
What is the molecular weight of 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea?
The molecular weight of 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea is 299.13 g/mol.
Where can I buy 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea?
You can request a quote for 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Dimethylphenyl)-3-(4-methyl-3-nitrophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.