![1-[Cyano(phenyl)methyl]-1-phenylurea structure](/static/products/7404/7404-11-7.webp)
1-[Cyano(phenyl)methyl]-1-phenylurea
TL;DR: 1-[Cyano(phenyl)methyl]-1-phenylurea (CAS 7404-11-7) is a chemical compound with molecular formula C15H13N3O and molecular weight 251.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[cyano(phenyl)methyl]-1-phenylurea
Also Known As: 1-[cyano(phenyl)methyl]-1-phenylurea, N-[Cyano(phenyl)methyl]-N-phenylurea
| Molecular Formula | C15H13N3O |
|---|---|
| Molecular Weight | 251.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 70.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.10587 |
| Heavy Atoms | 19 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 7404-11-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C#N)N(C2=CC=CC=C2)C(=O)N |
| InChIKey | HKWHYCGBDQRTGS-UHFFFAOYSA-N |
Product Overview
1-[Cyano(phenyl)methyl]-1-phenylurea (CAS 7404-11-7), with molecular formula C15H13N3O and molecular weight 251.11 g/mol. IUPAC: 1-[cyano(phenyl)methyl]-1-phenylurea.
Chemical Property Profile of 1-[Cyano(phenyl)methyl]-1-phenylurea
Property Insights of 1-[Cyano(phenyl)methyl]-1-phenylurea
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[Cyano(phenyl)methyl]-1-phenylurea. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[Cyano(phenyl)methyl]-1-phenylurea. Following Lipinski's Rule of Five, 1-[Cyano(phenyl)methyl]-1-phenylurea has 1 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-[Cyano(phenyl)methyl]-1-phenylurea?
The CAS number of 1-[Cyano(phenyl)methyl]-1-phenylurea is 7404-11-7.
What is the molecular formula of 1-[Cyano(phenyl)methyl]-1-phenylurea?
The molecular formula of 1-[Cyano(phenyl)methyl]-1-phenylurea is C15H13N3O.
What is the molecular weight of 1-[Cyano(phenyl)methyl]-1-phenylurea?
The molecular weight of 1-[Cyano(phenyl)methyl]-1-phenylurea is 251.11 g/mol.
Where can I buy 1-[Cyano(phenyl)methyl]-1-phenylurea?
You can request a quote for 1-[Cyano(phenyl)methyl]-1-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[Cyano(phenyl)methyl]-1-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-[Cyano(phenyl)methyl]-1-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.