Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester
TL;DR: Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester (CAS 108984-35-6) is a chemical compound with molecular formula C19H23NO3 and molecular weight 313.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[(2-hydroxynaphthalen-1-yl)methyl]piperidine-3-carboxylate
Also Known As: Ro 3-0570, 1-(3'-Ethoxycarbonylpiperidinomethyl)-2-naphthol, 1-((2-Hydroxy-1-naphthyl)methyl)nipecotic acid ethyl ester, 4-22-00-00124 (Beilstein Handbook Reference), ethyl 1-[(2-hydroxynaphthalen-1-yl)methyl]piperidine-3-carboxylate
| Molecular Formula | C19H23NO3 |
|---|---|
| Molecular Weight | 313.17 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.1678 |
| Heavy Atoms | 23 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 108984-35-6 |
|---|---|
| SMILES | CCOC(=O)C1CCCN(C1)CC2=C(C=CC3=CC=CC=C32)O |
| InChIKey | QVCOJNSOQPFNPA-UHFFFAOYSA-N |
Product Overview
Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester (CAS 108984-35-6), with molecular formula C19H23NO3 and molecular weight 313.17 g/mol. IUPAC: ethyl 1-[(2-hydroxynaphthalen-1-yl)methyl]piperidine-3-carboxylate.
Chemical Property Profile of Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester
Property Insights of Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester
The XLogP value of 3.4 indicates that Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl 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, Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl 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
Frequently Asked Questions
What is the CAS number of Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester?
The CAS number of Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester is 108984-35-6.
What is the molecular formula of Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester?
The molecular formula of Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester is C19H23NO3.
What is the molecular weight of Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester?
The molecular weight of Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester is 313.17 g/mol.
Where can I buy Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester?
You can request a quote for Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Nipecotic acid, 1-((2-hydroxy-1-naphthyl)methyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.