1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea
TL;DR: 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea (CAS 379717-10-9) is a chemical compound with molecular formula C13H14ClN3O and molecular weight 263.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-3-(2-methylquinolin-4-yl)urea
Also Known As: 1-(2-chloroethyl)-3-(2-methylquinolin-4-yl)urea, 1-(2-chloro-ethyl)-3-(2-methylquinolin-4-yl)-urea, 1-(2-chloroethyl)-3-(2-methyl-quinol-4-yl)-urea, 1-(2-chloroethyl)-3-(2-methylquinolin-4-yl)-urea, 1-(2-Chloro-ethyl)-3-(2-methyl-quinolin-4-yl)-urea
| Molecular Formula | C13H14ClN3O |
|---|---|
| Molecular Weight | 263.08 g/mol |
| LogP | 2.90352 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.08255 |
| Heavy Atoms | 18 |
| Complexity | 571.165 |
Chemical Identifiers
| CAS Number | 379717-10-9 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCCl |
Product Overview
1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea (CAS 379717-10-9), with molecular formula C13H14ClN3O and molecular weight 263.08 g/mol. IUPAC: 1-(2-chloroethyl)-3-(2-methylquinolin-4-yl)urea.
Chemical Property Profile of 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea
Property Insights of 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea
The XLogP value of 2.90352 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea. With a topological polar surface area (TPSA) of 54.02 Ų, 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea 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 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea?
The CAS number of 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea is 379717-10-9.
What is the molecular formula of 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea?
The molecular formula of 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea is C13H14ClN3O.
What is the molecular weight of 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea?
The molecular weight of 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea is 263.08 g/mol.
Where can I buy 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea?
You can request a quote for 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)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-Chloroethyl)-3-(2-methylquinolin-4-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chloroethyl)-3-(2-methylquinolin-4-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.