N-(3-cyanophenyl)-N'-phenylurea
TL;DR: N-(3-cyanophenyl)-N'-phenylurea (CAS 87597-64-6) is a chemical compound with molecular formula C14H11N3O and molecular weight 237.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-cyanophenyl)-3-phenylurea
Also Known As: 1-(3-cyanophenyl)-3-phenylurea, N-(3-cyanophenyl)-N'-phenylurea, Urea,N-(3-cyanophenyl)-N'-phenyl-, 1-(3-cyanophenyl)-3-phenyl-urea, N-(3-CYANOPHENYL)-N-PHENYLUREA
| Molecular Formula | C14H11N3O |
|---|---|
| Molecular Weight | 237.09 g/mol |
| LogP | 3.20228 |
| Topological Polar Surface Area | 64.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.09021 |
| Heavy Atoms | 18 |
| Complexity | 587.48816 |
Chemical Identifiers
| CAS Number | 87597-64-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NC2=CC=CC(=C2)C#N |
Product Overview
N-(3-cyanophenyl)-N'-phenylurea (CAS 87597-64-6), with molecular formula C14H11N3O and molecular weight 237.09 g/mol. IUPAC: 1-(3-cyanophenyl)-3-phenylurea.
Chemical Property Profile of N-(3-cyanophenyl)-N'-phenylurea
Property Insights of N-(3-cyanophenyl)-N'-phenylurea
The XLogP value of 3.20228 indicates that N-(3-cyanophenyl)-N'-phenylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.92 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-cyanophenyl)-N'-phenylurea. Following Lipinski's Rule of Five, N-(3-cyanophenyl)-N'-phenylurea has 2 hydrogen bond donor(s) and 2 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-(3-cyanophenyl)-N'-phenylurea?
The CAS number of N-(3-cyanophenyl)-N'-phenylurea is 87597-64-6.
What is the molecular formula of N-(3-cyanophenyl)-N'-phenylurea?
The molecular formula of N-(3-cyanophenyl)-N'-phenylurea is C14H11N3O.
What is the molecular weight of N-(3-cyanophenyl)-N'-phenylurea?
The molecular weight of N-(3-cyanophenyl)-N'-phenylurea is 237.09 g/mol.
Where can I buy N-(3-cyanophenyl)-N'-phenylurea?
You can request a quote for N-(3-cyanophenyl)-N'-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-cyanophenyl)-N'-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyanophenyl)-N'-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.