1-(5-Chloropyridin-2-yl)-3-cyclohexylurea
TL;DR: 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea (CAS 131519-61-4) is a chemical compound with molecular formula C12H16ClN3O and molecular weight 253.09819 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-chloro-2-pyridinyl)-3-cyclohexylurea
Also Known As: 1-(5-chloropyridin-2-yl)-3-cyclohexylurea, N-(5-chloro-2-pyridinyl)-N'-cyclohexylurea, AI-204/31695019
Technical Specifications
| Molecular Formula | C12H16ClN3O |
| Molecular Weight | 253.09819 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.09819 Da |
| Heavy Atoms | 17 |
| Complexity | 256.0 |
| SMILES | C1CCC(CC1)NC(=O)NC2=NC=C(C=C2)Cl |
| InChIKey | AFJVDWGRHOVKQW-UHFFFAOYSA-N |
Chemical Property Profile of 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea
Property Insights of 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea. With a topological polar surface area (TPSA) of 54.0 Ų, 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea 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
What is the CAS number of 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea?
The CAS number of 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea is 131519-61-4.
What is the molecular formula of 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea?
The molecular formula of 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea is C12H16ClN3O.
What is the molecular weight of 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea?
The molecular weight of 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea is 253.09819 g/mol.
Where can I buy 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea?
You can request a quote for 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea?
Yes, CoreyChem provides custom synthesis services for 1-(5-Chloropyridin-2-yl)-3-cyclohexylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.