1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea
TL;DR: 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea (CAS 445005-50-5) is a chemical compound with molecular formula C17H19ClN2O and molecular weight 302.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-butan-2-ylphenyl)-3-(4-chlorophenyl)urea
Also Known As: 1-(2-butan-2-ylphenyl)-3-(4-chlorophenyl)urea, N-(2-sec-butylphenyl)-N'-(4-chlorophenyl)urea, 1-[2-(butan-2-yl)phenyl]-3-(4-chlorophenyl)urea, N-[2-(SEC-BUTYL)PHENYL]-N'-(4-CHLOROPHENYL)UREA, N-(4-chlorophenyl){[2-(methylpropyl)phenyl]amino}carboxamide
| Molecular Formula | C17H19ClN2O |
|---|---|
| Molecular Weight | 302.12 g/mol |
| LogP | 5.4975 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.1186 |
| Heavy Atoms | 21 |
| Complexity | 610.4421 |
Chemical Identifiers
| CAS Number | 445005-50-5 |
|---|---|
| SMILES | CCC(C)C1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)Cl |
Product Overview
1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea (CAS 445005-50-5), with molecular formula C17H19ClN2O and molecular weight 302.12 g/mol. IUPAC: 1-(2-butan-2-ylphenyl)-3-(4-chlorophenyl)urea.
Chemical Property Profile of 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea
Property Insights of 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea
The XLogP value of 5.4975 indicates that 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea?
The CAS number of 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea is 445005-50-5.
What is the molecular formula of 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea?
The molecular formula of 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea is C17H19ClN2O.
What is the molecular weight of 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea?
The molecular weight of 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea is 302.12 g/mol.
Where can I buy 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea?
You can request a quote for 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Butan-2-ylphenyl)-3-(4-chlorophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.