N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea
TL;DR: N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea (CAS 701938-35-4) is a chemical compound with molecular formula C14H12FN3O3 and molecular weight 289.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]-3-(3-nitrophenyl)urea
Also Known As: N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea, 1-(4-fluorobenzyl)-3-(3-nitrophenyl)urea, 1-[(4-fluorophenyl)methyl]-3-(3-nitrophenyl)urea, {[(4-fluorophenyl)methyl]amino}-N-(3-nitrophenyl)carboxamide
| Molecular Formula | C14H12FN3O3 |
|---|---|
| Molecular Weight | 289.09 g/mol |
| LogP | 3.0556 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.08627 |
| Heavy Atoms | 21 |
| Complexity | 658.76874 |
Chemical Identifiers
| CAS Number | 701938-35-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)NCC2=CC=C(C=C2)F |
Product Overview
N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea (CAS 701938-35-4), with molecular formula C14H12FN3O3 and molecular weight 289.09 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]-3-(3-nitrophenyl)urea.
Chemical Property Profile of N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea
Property Insights of N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea
The XLogP value of 3.0556 indicates that N-(4-fluorobenzyl)-N'-(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 N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea. Following Lipinski's Rule of Five, N-(4-fluorobenzyl)-N'-(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 N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea?
The CAS number of N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea is 701938-35-4.
What is the molecular formula of N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea?
The molecular formula of N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea is C14H12FN3O3.
What is the molecular weight of N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea?
The molecular weight of N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea is 289.09 g/mol.
Where can I buy N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea?
You can request a quote for N-(4-fluorobenzyl)-N'-(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 N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-(4-fluorobenzyl)-N'-(3-nitrophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.