Urea, 1-benzyl-3-(2-chloroethyl)-
TL;DR: Urea, 1-benzyl-3-(2-chloroethyl)- (CAS 63668-36-0) is a chemical compound with molecular formula C10H13ClN2O and molecular weight 212.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-(2-chloroethyl)urea
Also Known As: 1-benzyl-3-(2-chloroethyl)urea, Urea, 1-benzyl-3-(2-chloroethyl)-, 1-(2-Chloroethyl)-3-benzylurea, N-Benzyl-N'-(2-chloroethyl)urea, 1-Benzyl-3-(2-chloro-ethyl)-urea
| Molecular Formula | C10H13ClN2O |
|---|---|
| Molecular Weight | 212.07 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 212.07164 |
| Heavy Atoms | 14 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 63668-36-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)NCCCl |
| InChIKey | CNQHZLLOIIQGKB-UHFFFAOYSA-N |
Product Overview
Urea, 1-benzyl-3-(2-chloroethyl)- (CAS 63668-36-0), with molecular formula C10H13ClN2O and molecular weight 212.07 g/mol. IUPAC: 1-benzyl-3-(2-chloroethyl)urea.
Chemical Property Profile of Urea, 1-benzyl-3-(2-chloroethyl)-
Property Insights of Urea, 1-benzyl-3-(2-chloroethyl)-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-benzyl-3-(2-chloroethyl)-. With a topological polar surface area (TPSA) of 41.1 Ų, Urea, 1-benzyl-3-(2-chloroethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-benzyl-3-(2-chloroethyl)- 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, 1-benzyl-3-(2-chloroethyl)-?
The CAS number of Urea, 1-benzyl-3-(2-chloroethyl)- is 63668-36-0.
What is the molecular formula of Urea, 1-benzyl-3-(2-chloroethyl)-?
The molecular formula of Urea, 1-benzyl-3-(2-chloroethyl)- is C10H13ClN2O.
What is the molecular weight of Urea, 1-benzyl-3-(2-chloroethyl)-?
The molecular weight of Urea, 1-benzyl-3-(2-chloroethyl)- is 212.07 g/mol.
Where can I buy Urea, 1-benzyl-3-(2-chloroethyl)-?
You can request a quote for Urea, 1-benzyl-3-(2-chloroethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-benzyl-3-(2-chloroethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-benzyl-3-(2-chloroethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.