1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea
TL;DR: 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea (CAS 790244-29-0) is a chemical compound with molecular formula C16H15N3O2 and molecular weight 281.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea
Also Known As: starbld0004428, 1-(cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea
| Molecular Formula | C16H15N3O2 |
|---|---|
| Molecular Weight | 281.12 g/mol |
| LogP | 3.25728 |
| Topological Polar Surface Area | 65.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.11642 |
| Heavy Atoms | 21 |
| Complexity | 650.0717 |
Chemical Identifiers
| CAS Number | 790244-29-0 |
|---|---|
| SMILES | COC1=CC=CC=C1NC(=O)N(CC#N)C2=CC=CC=C2 |
Product Overview
1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea (CAS 790244-29-0), with molecular formula C16H15N3O2 and molecular weight 281.12 g/mol. IUPAC: 1-(cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea.
Chemical Property Profile of 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea
Property Insights of 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea
The XLogP value of 3.25728 indicates that 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea. Following Lipinski's Rule of Five, 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea has 1 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 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea?
The CAS number of 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea is 790244-29-0.
What is the molecular formula of 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea?
The molecular formula of 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea is C16H15N3O2.
What is the molecular weight of 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea?
The molecular weight of 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea is 281.12 g/mol.
Where can I buy 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea?
You can request a quote for 1-(Cyanomethyl)-3-(2-methoxyphenyl)-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-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-(Cyanomethyl)-3-(2-methoxyphenyl)-1-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.