5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid
TL;DR: 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid (CAS 440343-72-6) is a chemical compound with molecular formula C15H12FNO4S and molecular weight 321.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2,3-dihydroindol-1-ylsulfonyl)-2-fluorobenzoic acid
Also Known As: 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid, 2-Fluoro-5-(indolin-1-ylsulfonyl)benzoic acid, ZERO/006119, 5-(2,3-dihydroindol-1-ylsulfonyl)-2-fluorobenzoic acid, 2-fluoro-5-(indolinylsulfonyl)benzoic acid
| Molecular Formula | C15H12FNO4S |
|---|---|
| Molecular Weight | 321.05 g/mol |
| LogP | 2.2753 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.04712 |
| Heavy Atoms | 22 |
| Complexity | 863.5962 |
Chemical Identifiers
| CAS Number | 440343-72-6 |
|---|---|
| SMILES | C1CN(C2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O |
Product Overview
5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid (CAS 440343-72-6), with molecular formula C15H12FNO4S and molecular weight 321.05 g/mol. IUPAC: 5-(2,3-dihydroindol-1-ylsulfonyl)-2-fluorobenzoic acid.
Chemical Property Profile of 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid
Property Insights of 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid
The XLogP value of 2.2753 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid. Following Lipinski's Rule of Five, 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic 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 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid?
The CAS number of 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid is 440343-72-6.
What is the molecular formula of 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid?
The molecular formula of 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid is C15H12FNO4S.
What is the molecular weight of 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid?
The molecular weight of 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid is 321.05 g/mol.
Where can I buy 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid?
You can request a quote for 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-fluorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.