Propinetidine
TL;DR: Propinetidine (CAS 3811-53-8) is a chemical compound with molecular formula C19H25NO2 and molecular weight 299.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(2-phenylethyl)-4-prop-2-ynylpiperidin-4-yl] propanoate
Also Known As: Propinetidine, propinetidina, propinetidinum, Propinetidine [INN], [1-(2-phenylethyl)-4-prop-2-ynylpiperidin-4-yl] propanoate
| Molecular Formula | C19H25NO2 |
|---|---|
| Molecular Weight | 299.19 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 299.18854 |
| Heavy Atoms | 22 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 3811-53-8 |
|---|---|
| SMILES | CCC(=O)OC1(CCN(CC1)CCC2=CC=CC=C2)CC#C |
| InChIKey | BPWLAJREXKWKSB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propinetidine (CAS 3811-53-8), with molecular formula C19H25NO2 and molecular weight 299.19 g/mol. IUPAC: [1-(2-phenylethyl)-4-prop-2-ynylpiperidin-4-yl] propanoate.
Chemical Property Profile of Propinetidine
Property Insights of Propinetidine
The XLogP value of 3.5 indicates that Propinetidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Propinetidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propinetidine 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 Propinetidine?
The CAS number of Propinetidine is 3811-53-8.
What is the molecular formula of Propinetidine?
The molecular formula of Propinetidine is C19H25NO2.
What is the molecular weight of Propinetidine?
The molecular weight of Propinetidine is 299.19 g/mol.
Where can I buy Propinetidine?
You can request a quote for Propinetidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propinetidine?
Yes, KEHONG BIO provides custom synthesis services for Propinetidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.