Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester
TL;DR: Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester (CAS 92956-72-4) is a chemical compound with molecular formula C17H27NO3 and molecular weight 293.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methylpiperidin-4-yl) 2-cyclohexyl-2-hydroxypent-3-ynoate
Also Known As: 1-Methyl-4-piperidyl cyclohexyl(1-propynyl)glycolate, NCI60_022538, Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester, 1-Methyl-4-piperidinyl 2-cyclohexyl-2-hydroxy-3-pentynoate, 1-Methylpiperidin-4-yl 2-cyclohexyl-2-hydroxypent-3-ynoate
| Molecular Formula | C17H27NO3 |
|---|---|
| Molecular Weight | 293.20 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 293.1991 |
| Heavy Atoms | 21 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 92956-72-4 |
|---|---|
| SMILES | CC#CC(C1CCCCC1)(C(=O)OC2CCN(CC2)C)O |
| InChIKey | KYEFWBWWXAMWAJ-UHFFFAOYSA-N |
Product Overview
Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester (CAS 92956-72-4), with molecular formula C17H27NO3 and molecular weight 293.20 g/mol. IUPAC: (1-methylpiperidin-4-yl) 2-cyclohexyl-2-hydroxypent-3-ynoate.
Chemical Property Profile of Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester
Property Insights of Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester
The XLogP value of 3.1 indicates that Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester has 1 hydrogen bond donor(s) and 4 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 Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester?
The CAS number of Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester is 92956-72-4.
What is the molecular formula of Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester?
The molecular formula of Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester is C17H27NO3.
What is the molecular weight of Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester?
The molecular weight of Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester is 293.20 g/mol.
Where can I buy Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester?
You can request a quote for Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexaneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.