4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate
TL;DR: 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate (CAS 102071-57-8) is a chemical compound with molecular formula C35H55N3O20 and molecular weight 837.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris((2R,3R)-2,3-dihydroxybutanedioic acid);[2,5-dimethyl-1-[2-(4-methylpiperazin-1-yl)ethyl]-4-phenylpiperidin-4-yl] propanoate
Also Known As: 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate, (2R,3R)-2,3-Dihydroxybutanedioic acid--2,5-dimethyl-1-[2-(4-methylpiperazin-1-yl)ethyl]-4-phenylpiperidin-4-yl propanoate (3/1), (2R,3R)-2,3-dihydroxybutanedioic acid; [2,5-dimethyl-1-[2-(4-methylpiperazin-1-yl)ethyl]-4-phenylpiperidin-4-yl] propanoate, 2,3-Dihydroxybutanedioic acid--2,5-dimethyl-1-[2-(4-methylpiperazin-1-yl)ethyl]-4-phenylpiperidin-4-yl propanoate (3/1), RefChem:295805
| Molecular Formula | C35H55N3O20 |
|---|---|
| Molecular Weight | 837.34 g/mol |
| LogP | -3.555 |
| Topological Polar Surface Area | 381.2 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 15 |
| Exact Mass | 837.3379 |
| Heavy Atoms | 58 |
| Complexity | 1352.6295 |
Chemical Identifiers
| CAS Number | 102071-57-8 |
|---|---|
| SMILES | CCC(=O)OC1(CC(N(CC1C)CCN2CCN(CC2)C)C)C3=CC=CC=C3.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.[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
4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate (CAS 102071-57-8), with molecular formula C35H55N3O20 and molecular weight 837.34 g/mol. IUPAC: tris((2R,3R)-2,3-dihydroxybutanedioic acid);[2,5-dimethyl-1-[2-(4-methylpiperazin-1-yl)ethyl]-4-phenylpiperidin-4-yl] propanoate.
Chemical Property Profile of 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate
Property Insights of 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate
The XLogP value of -3.555 indicates that 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 381.2 Ų indicates high polarity, suggesting 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate has 12 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate?
The CAS number of 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate is 102071-57-8.
What is the molecular formula of 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate?
The molecular formula of 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate is C35H55N3O20.
What is the molecular weight of 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate?
The molecular weight of 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate is 837.34 g/mol.
Where can I buy 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate?
You can request a quote for 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate?
Yes, KEHONG BIO provides custom synthesis services for 4-Piperidinol, 2,5-dimethyl-1-(2-(4-methyl-1-piperazinyl)ethyl)-4-phenyl-, propionate (ester),tritartrate, dihydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.