1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea
TL;DR: 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea (CAS 33164-65-7) is a chemical compound with molecular formula C15H20ClN3O2 and molecular weight 309.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-3-[4-(piperidine-1-carbonyl)phenyl]urea
Also Known As: KST-1B3186, 1-(2-chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea, 1-(2-chloroethyl)-3-[4-(piperidine-1-carbonyl)phenyl]urea, 1-{4-[3-(2-chloro-ethyl)-ureido]-benzoyl}-piperidine, N-(2-Chloroethyl)-N'-[4-(piperidine-1-carbonyl)phenyl]urea
| Molecular Formula | C15H20ClN3O2 |
|---|---|
| Molecular Weight | 309.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.1244 |
| Heavy Atoms | 21 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 33164-65-7 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)C2=CC=C(C=C2)NC(=O)NCCCl |
| InChIKey | KRVOEFGWHJORJA-UHFFFAOYSA-N |
Product Overview
1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea (CAS 33164-65-7), with molecular formula C15H20ClN3O2 and molecular weight 309.12 g/mol. IUPAC: 1-(2-chloroethyl)-3-[4-(piperidine-1-carbonyl)phenyl]urea.
Chemical Property Profile of 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea
Property Insights of 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea. Following Lipinski's Rule of Five, 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]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-[4-(piperidin-1-ylcarbonyl)phenyl]urea?
The CAS number of 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea is 33164-65-7.
What is the molecular formula of 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea?
The molecular formula of 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea is C15H20ClN3O2.
What is the molecular weight of 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea?
The molecular weight of 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea is 309.12 g/mol.
Where can I buy 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea?
You can request a quote for 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]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-[4-(piperidin-1-ylcarbonyl)phenyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chloroethyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.