1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate
TL;DR: 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate (CAS 54521-85-6) is a chemical compound with molecular formula C30H48N2O14 and molecular weight 660.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[2-(diethylamino)ethyl]-2,5-dimethyl-4-phenylpiperidin-4-yl] propanoate;bis((2S,3S)-2,3-dihydroxybutanedioic acid)
Also Known As: 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate, 4-Piperidinol, 1-(2-(diethylamino)ethyl)-2,5-dimethyl-4-phenyl-, propanoate (ester), 2C4H6O6, Piperidine, 1-(2-diethylaminoethyl)-2,5-dimethyl-4-phenyl-4-propionyloxy-, ditartrate, dihydrate, Propionic acid, (2,5-dimethyl-1-(2-diethylaminoethyl)-4-phenylpiperidinyl) ester, ditartrate, (2S,3S)-2,3-Dihydroxybutanedioic acid--1-[2-(diethylamino)ethyl]-2,5-dimethyl-4-phenylpiperidin-4-yl propanoate (2/1)
| Molecular Formula | C30H48N2O14 |
|---|---|
| Molecular Weight | 660.31 g/mol |
| LogP | -0.338 |
| Topological Polar Surface Area | 262.9 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 14 |
| Exact Mass | 660.31055 |
| Heavy Atoms | 46 |
| Complexity | 1044.0895 |
Chemical Identifiers
| CAS Number | 54521-85-6 |
|---|---|
| SMILES | CCC(=O)OC1(CC(N(CC1C)CCN(CC)CC)C)C2=CC=CC=C2.[C@H]([C@@H](C(=O)O)O)(C(=O)O)O.[C@H]([C@@H](C(=O)O)O)(C(=O)O)O |
Product Overview
1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate (CAS 54521-85-6), with molecular formula C30H48N2O14 and molecular weight 660.31 g/mol. IUPAC: [1-[2-(diethylamino)ethyl]-2,5-dimethyl-4-phenylpiperidin-4-yl] propanoate;bis((2S,3S)-2,3-dihydroxybutanedioic acid).
Chemical Property Profile of 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate
Property Insights of 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate
The XLogP value of -0.338 indicates that 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 262.9 Ų indicates high polarity, suggesting 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate?
The CAS number of 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate is 54521-85-6.
What is the molecular formula of 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate?
The molecular formula of 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate is C30H48N2O14.
What is the molecular weight of 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate?
The molecular weight of 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate is 660.31 g/mol.
Where can I buy 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate?
You can request a quote for 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate?
Yes, KEHONG BIO provides custom synthesis services for 1-(beta-Diethylaminoethyl)-2,5-dimethyl-4-propionyloxy-4-phenylpiperidine ditartrate dihydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.