Urea, N-butyl-N'-(1-phenylethyl)-
TL;DR: Urea, N-butyl-N'-(1-phenylethyl)- (CAS 113962-89-3) is a chemical compound with molecular formula C13H20N2O and molecular weight 220.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-3-(1-phenylethyl)urea
Also Known As: Urea, N-butyl-N'-(1-phenylethyl)-, 1-butyl-3-(1-phenylethyl)urea, N-Butyl-N'-(1-phenylethyl)urea, 4-Cyclopentene-1,3-diol,1-butyl-4-fluoro
| Molecular Formula | C13H20N2O |
|---|---|
| Molecular Weight | 220.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 220.15756 |
| Heavy Atoms | 16 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 113962-89-3 |
|---|---|
| SMILES | CCCCNC(=O)NC(C)C1=CC=CC=C1 |
| InChIKey | AATIUZSOSDLYBV-UHFFFAOYSA-N |
Product Overview
Urea, N-butyl-N'-(1-phenylethyl)- (CAS 113962-89-3), with molecular formula C13H20N2O and molecular weight 220.16 g/mol. IUPAC: 1-butyl-3-(1-phenylethyl)urea.
Chemical Property Profile of Urea, N-butyl-N'-(1-phenylethyl)-
Property Insights of Urea, N-butyl-N'-(1-phenylethyl)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N-butyl-N'-(1-phenylethyl)-. With a topological polar surface area (TPSA) of 41.1 Ų, Urea, N-butyl-N'-(1-phenylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, N-butyl-N'-(1-phenylethyl)- has 2 hydrogen bond donor(s) and 1 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, N-butyl-N'-(1-phenylethyl)-?
The CAS number of Urea, N-butyl-N'-(1-phenylethyl)- is 113962-89-3.
What is the molecular formula of Urea, N-butyl-N'-(1-phenylethyl)-?
The molecular formula of Urea, N-butyl-N'-(1-phenylethyl)- is C13H20N2O.
What is the molecular weight of Urea, N-butyl-N'-(1-phenylethyl)-?
The molecular weight of Urea, N-butyl-N'-(1-phenylethyl)- is 220.16 g/mol.
Where can I buy Urea, N-butyl-N'-(1-phenylethyl)-?
You can request a quote for Urea, N-butyl-N'-(1-phenylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, N-butyl-N'-(1-phenylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, N-butyl-N'-(1-phenylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.