Desbutyl dibucaine
TL;DR: Desbutyl dibucaine (CAS 87864-08-2) is a chemical compound with molecular formula C16H21N3O2 and molecular weight 287.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(diethylamino)ethyl]-2-oxo-1H-quinoline-4-carboxamide
Also Known As: Desbutyl dibucaine, DesbutylDibucaine, Cinchocaine EP Impurity C, N-[2-(Diethylamino)ethyl]-2-hydroxyquinoline-4-carboxamide, Cinchocaine hydrochloride impurity C [EP]
| Molecular Formula | C16H21N3O2 |
|---|---|
| Molecular Weight | 287.16 g/mol |
| LogP | 1.5997 |
| Topological Polar Surface Area | 65.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 287.1634 |
| Heavy Atoms | 21 |
| Complexity | 674.5216 |
Chemical Identifiers
| CAS Number | 87864-08-2 |
|---|---|
| SMILES | CCN(CC)CCNC(=O)C1=CC(=O)NC2=CC=CC=C21 |
Product Overview
Desbutyl dibucaine (CAS 87864-08-2), with molecular formula C16H21N3O2 and molecular weight 287.16 g/mol. IUPAC: N-[2-(diethylamino)ethyl]-2-oxo-1H-quinoline-4-carboxamide.
Chemical Property Profile of Desbutyl dibucaine
Property Insights of Desbutyl dibucaine
The XLogP value of 1.5997 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Desbutyl dibucaine. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Desbutyl dibucaine. Following Lipinski's Rule of Five, Desbutyl dibucaine has 2 hydrogen bond donor(s) and 3 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 Desbutyl dibucaine?
The CAS number of Desbutyl dibucaine is 87864-08-2.
What is the molecular formula of Desbutyl dibucaine?
The molecular formula of Desbutyl dibucaine is C16H21N3O2.
What is the molecular weight of Desbutyl dibucaine?
The molecular weight of Desbutyl dibucaine is 287.16 g/mol.
Where can I buy Desbutyl dibucaine?
You can request a quote for Desbutyl dibucaine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Desbutyl dibucaine?
Yes, KEHONG BIO provides custom synthesis services for Desbutyl dibucaine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.