Piperidine, 2-propenyl-, ()-
TL;DR: Piperidine, 2-propenyl-, ()- (CAS 5913-87-1) is a chemical compound with molecular formula C20H18ClNO6 and molecular weight 403.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-[2-(4-chlorophenyl)-2-oxoethyl] 1-O-phenyl 4-hydroxypyrrolidine-1,2-dicarboxylate
Also Known As: Piperidine, 2-propenyl-, ()-, Piperidine, 2-(1-propenyl)-, ()-, BAS 01362705, BIM-0008485.P001, 2-[2-(4-Chlorophenyl)-2-oxoethyl] 1-phenyl 4-hydroxypyrrolidine-1,2-dicarboxylate
| Molecular Formula | C20H18ClNO6 |
|---|---|
| Molecular Weight | 403.08 g/mol |
| LogP | 2.7001 |
| Topological Polar Surface Area | 93.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.08228 |
| Heavy Atoms | 28 |
| Complexity | 854.75946 |
Chemical Identifiers
| CAS Number | 5913-87-1 |
|---|---|
| SMILES | C1C(CN(C1C(=O)OCC(=O)C2=CC=C(C=C2)Cl)C(=O)OC3=CC=CC=C3)O |
Product Overview
Piperidine, 2-propenyl-, ()- (CAS 5913-87-1), with molecular formula C20H18ClNO6 and molecular weight 403.08 g/mol. IUPAC: 2-O-[2-(4-chlorophenyl)-2-oxoethyl] 1-O-phenyl 4-hydroxypyrrolidine-1,2-dicarboxylate.
Chemical Property Profile of Piperidine, 2-propenyl-, ()-
Property Insights of Piperidine, 2-propenyl-, ()-
The XLogP value of 2.7001 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperidine, 2-propenyl-, ()-. The TPSA of 93.14 Ų falls within the moderate polarity range, balancing permeability and solubility for Piperidine, 2-propenyl-, ()-. Following Lipinski's Rule of Five, Piperidine, 2-propenyl-, ()- has 1 hydrogen bond donor(s) and 6 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 Piperidine, 2-propenyl-, ()-?
The CAS number of Piperidine, 2-propenyl-, ()- is 5913-87-1.
What is the molecular formula of Piperidine, 2-propenyl-, ()-?
The molecular formula of Piperidine, 2-propenyl-, ()- is C20H18ClNO6.
What is the molecular weight of Piperidine, 2-propenyl-, ()-?
The molecular weight of Piperidine, 2-propenyl-, ()- is 403.08 g/mol.
Where can I buy Piperidine, 2-propenyl-, ()-?
You can request a quote for Piperidine, 2-propenyl-, ()- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidine, 2-propenyl-, ()-?
Yes, KEHONG BIO provides custom synthesis services for Piperidine, 2-propenyl-, ()- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.