Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester
TL;DR: Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester (CAS 102395-66-4) is a chemical compound with molecular formula C20H23NO3 and molecular weight 325.1678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzhydryl 4-hydroxy-1-methylpiperidine-4-carboxylate
Also Known As: Diphenylmethyl 4-hydroxy-1-methylisonipecotate, ISONIPECOTIC ACID, 4-HYDROXY-1-METHYL-, DIPHENYLMETHYL ESTER, benzhydryl 4-hydroxy-1-methylpiperidine-4-carboxylate, diphenylmethyl 4-hydroxy-1-methylpiperidine-4-carboxylate, 4-Hydroxy-1-methyl-4-piperidinecarboxylic acid diphenylmethyl ester
Technical Specifications
| Molecular Formula | C20H23NO3 |
| Molecular Weight | 325.1678 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.1678 Da |
| Heavy Atoms | 24 |
| Complexity | 387.0 |
| SMILES | CN1CCC(CC1)(C(=O)OC(C2=CC=CC=C2)C3=CC=CC=C3)O |
| InChIKey | GFXQTCCWCSVYAN-UHFFFAOYSA-N |
Chemical Property Profile of Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester
Property Insights of Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester
The XLogP value of 3.0 indicates that Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl 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, Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl 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
What is the CAS number of Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester?
The CAS number of Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester is 102395-66-4.
What is the molecular formula of Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester?
The molecular formula of Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester is C20H23NO3.
What is the molecular weight of Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester?
The molecular weight of Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester is 325.1678 g/mol.
Where can I buy Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester?
You can request a quote for Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester?
Yes, CoreyChem provides custom synthesis services for Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.