Urea, 1-(2-chloroethyl)-3-(2-pyridyl)-
TL;DR: Urea, 1-(2-chloroethyl)-3-(2-pyridyl)- (CAS 62491-89-8) is a chemical compound with molecular formula C8H10ClN3O and molecular weight 199.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-3-pyridin-2-ylurea
Also Known As: 1-(2-chloroethyl)-3-pyridin-2-ylurea, Urea, 1-(2-chloroethyl)-3-(2-pyridyl)-, 1-(2-Chloroethyl)-3-(2-pyridyl)urea, 1-(2-chloroethyl)-3-(pyridin-2-yl)urea, N-(2-Chloroethyl)-N'-(2-pyridinyl)urea
| Molecular Formula | C8H10ClN3O |
|---|---|
| Molecular Weight | 199.05 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 199.05124 |
| Heavy Atoms | 13 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 62491-89-8 |
|---|---|
| SMILES | C1=CC=NC(=C1)NC(=O)NCCCl |
| InChIKey | KRXWZDLRVLENPP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Urea, 1-(2-chloroethyl)-3-(2-pyridyl)- (CAS 62491-89-8), with molecular formula C8H10ClN3O and molecular weight 199.05 g/mol. IUPAC: 1-(2-chloroethyl)-3-pyridin-2-ylurea.
Chemical Property Profile of Urea, 1-(2-chloroethyl)-3-(2-pyridyl)-
Property Insights of Urea, 1-(2-chloroethyl)-3-(2-pyridyl)-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-(2-chloroethyl)-3-(2-pyridyl)-. With a topological polar surface area (TPSA) of 54.0 Ų, Urea, 1-(2-chloroethyl)-3-(2-pyridyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-(2-chloroethyl)-3-(2-pyridyl)- 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 Urea, 1-(2-chloroethyl)-3-(2-pyridyl)-?
The CAS number of Urea, 1-(2-chloroethyl)-3-(2-pyridyl)- is 62491-89-8.
What is the molecular formula of Urea, 1-(2-chloroethyl)-3-(2-pyridyl)-?
The molecular formula of Urea, 1-(2-chloroethyl)-3-(2-pyridyl)- is C8H10ClN3O.
What is the molecular weight of Urea, 1-(2-chloroethyl)-3-(2-pyridyl)-?
The molecular weight of Urea, 1-(2-chloroethyl)-3-(2-pyridyl)- is 199.05 g/mol.
Where can I buy Urea, 1-(2-chloroethyl)-3-(2-pyridyl)-?
You can request a quote for Urea, 1-(2-chloroethyl)-3-(2-pyridyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-(2-chloroethyl)-3-(2-pyridyl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-(2-chloroethyl)-3-(2-pyridyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.