3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl-
TL;DR: 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl- (CAS 112392-94-6) is a chemical compound with molecular formula C22H24N2O3 and molecular weight 364.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(diethylamino)ethyl]-1-oxo-4-phenylisoquinoline-3-carboxylic acid
Also Known As: 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl-, 2-(2-(Diethylamino)ethyl)-1-oxo-4-phenyl-1,2-dihydro-3-isoquinolinecarboxylic acid, 3-Isoquinolinecarboxylicacid, 2-[2-(diethylamino)ethyl]-1,2-dihydro-1-oxo-4-phenyl-, 2-(2-diethylaminoethyl)-1-oxo-4-phenylisoquinoline-3-carboxylic acid, 2-[2-(diethylamino)ethyl]-1-oxo-4-phenylisoquinoline-3-carboxylic acid
| Molecular Formula | C22H24N2O3 |
|---|---|
| Molecular Weight | 364.18 g/mol |
| LogP | 3.7085 |
| Topological Polar Surface Area | 62.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 364.17868 |
| Heavy Atoms | 27 |
| Complexity | 1005.23676 |
Chemical Identifiers
| CAS Number | 112392-94-6 |
|---|---|
| SMILES | CCN(CC)CCN1C(=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)C(=O)O |
Product Overview
3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl- (CAS 112392-94-6), with molecular formula C22H24N2O3 and molecular weight 364.18 g/mol. IUPAC: 2-[2-(diethylamino)ethyl]-1-oxo-4-phenylisoquinoline-3-carboxylic acid.
Chemical Property Profile of 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl-
Property Insights of 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl-
The XLogP value of 3.7085 indicates that 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl-. Following Lipinski's Rule of Five, 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl- has 1 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 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl-?
The CAS number of 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl- is 112392-94-6.
What is the molecular formula of 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl-?
The molecular formula of 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl- is C22H24N2O3.
What is the molecular weight of 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl-?
The molecular weight of 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl- is 364.18 g/mol.
Where can I buy 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl-?
You can request a quote for 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(2-(diethylamino)ethyl)-1-oxo-4-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.