1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea
TL;DR: 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea (CAS 5109-51-3) is a chemical compound with molecular formula C14H10ClN3O and molecular weight 271.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chlorophenyl)-3-(2-cyanophenyl)urea
Also Known As: 1-(3-chlorophenyl)-3-(2-cyanophenyl)urea, N-(3-Chlorophenyl)-N'-(2-cyanophenyl)urea
| Molecular Formula | C14H10ClN3O |
|---|---|
| Molecular Weight | 271.05 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 64.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.05124 |
| Heavy Atoms | 19 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 5109-51-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C#N)NC(=O)NC2=CC(=CC=C2)Cl |
| InChIKey | DYNXMDAIFXXRPE-UHFFFAOYSA-N |
Product Overview
1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea (CAS 5109-51-3), with molecular formula C14H10ClN3O and molecular weight 271.05 g/mol. IUPAC: 1-(3-chlorophenyl)-3-(2-cyanophenyl)urea.
Chemical Property Profile of 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea
Property Insights of 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea. Following Lipinski's Rule of Five, 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea 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 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea?
The CAS number of 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea is 5109-51-3.
What is the molecular formula of 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea?
The molecular formula of 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea is C14H10ClN3O.
What is the molecular weight of 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea?
The molecular weight of 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea is 271.05 g/mol.
Where can I buy 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea?
You can request a quote for 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chlorophenyl)-3-(2-cyanophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.