Bupivacaine 3-hydroxy-2-naphthoate
TL;DR: Bupivacaine 3-hydroxy-2-naphthoate (CAS 66558-79-0) is a chemical compound with molecular formula C29H36N2O4 and molecular weight 476.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide;3-hydroxynaphthalene-2-carboxylic acid
Also Known As: Bupivacaine 3-hydroxy-2-naphthoate, 1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide; 3-hydroxynaphthalene-2-carboxylic Acid, 1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide,3-hydroxynaphthalene-2-carboxylic acid, 3-Hydroxynaphthalene-2-carboxylic acid--1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboximidic acid (1/1), 3-hydroxynaphthalene-2-carboxylic acid-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide (1:1)
| Molecular Formula | C29H36N2O4 |
|---|---|
| Molecular Weight | 476.27 g/mol |
| LogP | 6.14014 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 476.26752 |
| Heavy Atoms | 35 |
| Complexity | 548.0 |
Chemical Identifiers
| CAS Number | 66558-79-0 |
|---|---|
| SMILES | CCCCN1CCCCC1C(=O)NC2=C(C=CC=C2C)C.C1=CC=C2C=C(C(=CC2=C1)C(=O)O)O |
| InChIKey | GPBFSNHGCGQMGA-UHFFFAOYSA-N |
Product Overview
Bupivacaine 3-hydroxy-2-naphthoate (CAS 66558-79-0), with molecular formula C29H36N2O4 and molecular weight 476.27 g/mol. IUPAC: 1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide;3-hydroxynaphthalene-2-carboxylic acid.
Chemical Property Profile of Bupivacaine 3-hydroxy-2-naphthoate
Property Insights of Bupivacaine 3-hydroxy-2-naphthoate
The XLogP value of 6.14014 indicates that Bupivacaine 3-hydroxy-2-naphthoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Bupivacaine 3-hydroxy-2-naphthoate. Following Lipinski's Rule of Five, Bupivacaine 3-hydroxy-2-naphthoate has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bupivacaine 3-hydroxy-2-naphthoate?
The CAS number of Bupivacaine 3-hydroxy-2-naphthoate is 66558-79-0.
What is the molecular formula of Bupivacaine 3-hydroxy-2-naphthoate?
The molecular formula of Bupivacaine 3-hydroxy-2-naphthoate is C29H36N2O4.
What is the molecular weight of Bupivacaine 3-hydroxy-2-naphthoate?
The molecular weight of Bupivacaine 3-hydroxy-2-naphthoate is 476.27 g/mol.
Where can I buy Bupivacaine 3-hydroxy-2-naphthoate?
You can request a quote for Bupivacaine 3-hydroxy-2-naphthoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bupivacaine 3-hydroxy-2-naphthoate?
Yes, KEHONG BIO provides custom synthesis services for Bupivacaine 3-hydroxy-2-naphthoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.