2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid
TL;DR: 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid (CAS 293766-18-4) is a chemical compound with molecular formula C17H15NO3 and molecular weight 281.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dihydro-2H-quinoline-1-carbonyl)benzoic acid
Also Known As: Maybridge3_003082, IDI1_014469, 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid, 2-(3,4-dihydro-2H-quinoline-1-carbonyl)benzoic acid, 2-(3,4-dihydro-1(2H)-quinolinylcarbonyl)benzoic acid
| Molecular Formula | C17H15NO3 |
|---|---|
| Molecular Weight | 281.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.1052 |
| Heavy Atoms | 21 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 293766-18-4 |
|---|---|
| SMILES | C1CC2=CC=CC=C2N(C1)C(=O)C3=CC=CC=C3C(=O)O |
| InChIKey | QUPCXXJKLLWREX-UHFFFAOYSA-N |
Product Overview
2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid (CAS 293766-18-4), with molecular formula C17H15NO3 and molecular weight 281.11 g/mol. IUPAC: 2-(3,4-dihydro-2H-quinoline-1-carbonyl)benzoic acid.
Chemical Property Profile of 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid
Property Insights of 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid. With a topological polar surface area (TPSA) of 57.6 Ų, 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid 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 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid?
The CAS number of 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid is 293766-18-4.
What is the molecular formula of 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid?
The molecular formula of 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid is C17H15NO3.
What is the molecular weight of 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid?
The molecular weight of 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid is 281.11 g/mol.
Where can I buy 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid?
You can request a quote for 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.