Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester
TL;DR: Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester (CAS 63884-41-3) is a chemical compound with molecular formula C18H27NO2 and molecular weight 289.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylpiperidin-1-yl)propyl 3-phenylpropanoate
Also Known As: 1,3-Dithiane,2,2-diethyl, 3-(2'-Methylpiperidino)propyl hydrocinnamate, 3-(2-methylpiperidin-1-yl)propyl 3-phenylpropanoate, Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester, 3-Phenylpropanoic acid 3-(2-methylpiperidino)propyl ester
| Molecular Formula | C18H27NO2 |
|---|---|
| Molecular Weight | 289.20 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 289.2042 |
| Heavy Atoms | 21 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 63884-41-3 |
|---|---|
| SMILES | CC1CCCCN1CCCOC(=O)CCC2=CC=CC=C2 |
| InChIKey | ASKZGJDEXADJKD-UHFFFAOYSA-N |
Product Overview
Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester (CAS 63884-41-3), with molecular formula C18H27NO2 and molecular weight 289.20 g/mol. IUPAC: 3-(2-methylpiperidin-1-yl)propyl 3-phenylpropanoate.
Chemical Property Profile of Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester
Property Insights of Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester
The XLogP value of 3.7 indicates that Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester has 0 hydrogen bond donor(s) and 3 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 Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester?
The CAS number of Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester is 63884-41-3.
What is the molecular formula of Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester?
The molecular formula of Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester is C18H27NO2.
What is the molecular weight of Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester?
The molecular weight of Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester is 289.20 g/mol.
Where can I buy Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester?
You can request a quote for Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.