5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid
TL;DR: 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid (CAS 170287-67-9) is a chemical compound with molecular formula C16H15NO5S and molecular weight 333.07 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-methoxybenzoic acid
Also Known As: 5-(2,3-Dihydro-indole-1-sulfonyl)-2-methoxy-benzoic acid, IFLab1_004208, 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid, 5-(indolin-1-ylsulfonyl)-2-methoxybenzoic acid, BAS 03353130
| Molecular Formula | C16H15NO5S |
|---|---|
| Molecular Weight | 333.07 g/mol |
| LogP | 2.1448 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.0671 |
| Heavy Atoms | 23 |
| Complexity | 875.78937 |
Chemical Identifiers
| CAS Number | 170287-67-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32)C(=O)O |
Product Overview
5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid (CAS 170287-67-9), with molecular formula C16H15NO5S and molecular weight 333.07 g/mol. IUPAC: 5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxybenzoic acid.
Chemical Property Profile of 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid
Property Insights of 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid
The XLogP value of 2.1448 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid. The TPSA of 83.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid. Following Lipinski's Rule of Five, 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid has 1 hydrogen bond donor(s) and 4 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-indole-1-sulfonyl)-2-methoxybenzoic acid?
The CAS number of 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid is 170287-67-9.
What is the molecular formula of 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid?
The molecular formula of 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid is C16H15NO5S.
What is the molecular weight of 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid?
The molecular weight of 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid is 333.07 g/mol.
Where can I buy 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid?
You can request a quote for 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic 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-indole-1-sulfonyl)-2-methoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.