Urea, 1-cyanomethyl-3-(1-naphthyl)-
TL;DR: Urea, 1-cyanomethyl-3-(1-naphthyl)- (CAS 102433-06-7) is a chemical compound with molecular formula C13H11N3O and molecular weight 225.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(cyanomethyl)-3-naphthalen-1-ylurea
Also Known As: 1-Cyanomethyl-3-(1-naphthyl)urea, 3-Cyanomethyl-1-(1-naphthyl)urea, Urea, 1-cyanomethyl-3-(1-naphthyl)-, 1-(cyanomethyl)-3-naphthalen-1-ylurea, Urea,N-(cyanomethyl)-N'-1-naphthalenyl-
| Molecular Formula | C13H11N3O |
|---|---|
| Molecular Weight | 225.09 g/mol |
| LogP | 2.48488 |
| Topological Polar Surface Area | 64.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.09021 |
| Heavy Atoms | 17 |
| Complexity | 581.22943 |
Chemical Identifiers
| CAS Number | 102433-06-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2NC(=O)NCC#N |
Product Overview
Urea, 1-cyanomethyl-3-(1-naphthyl)- (CAS 102433-06-7), with molecular formula C13H11N3O and molecular weight 225.09 g/mol. IUPAC: 1-(cyanomethyl)-3-naphthalen-1-ylurea.
Chemical Property Profile of Urea, 1-cyanomethyl-3-(1-naphthyl)-
Property Insights of Urea, 1-cyanomethyl-3-(1-naphthyl)-
The XLogP value of 2.48488 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-cyanomethyl-3-(1-naphthyl)-. The TPSA of 64.92 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, 1-cyanomethyl-3-(1-naphthyl)-. Following Lipinski's Rule of Five, Urea, 1-cyanomethyl-3-(1-naphthyl)- 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 Urea, 1-cyanomethyl-3-(1-naphthyl)-?
The CAS number of Urea, 1-cyanomethyl-3-(1-naphthyl)- is 102433-06-7.
What is the molecular formula of Urea, 1-cyanomethyl-3-(1-naphthyl)-?
The molecular formula of Urea, 1-cyanomethyl-3-(1-naphthyl)- is C13H11N3O.
What is the molecular weight of Urea, 1-cyanomethyl-3-(1-naphthyl)-?
The molecular weight of Urea, 1-cyanomethyl-3-(1-naphthyl)- is 225.09 g/mol.
Where can I buy Urea, 1-cyanomethyl-3-(1-naphthyl)-?
You can request a quote for Urea, 1-cyanomethyl-3-(1-naphthyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-cyanomethyl-3-(1-naphthyl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-cyanomethyl-3-(1-naphthyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.