1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)-
TL;DR: 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)- (CAS 120729-91-1) is a chemical compound with molecular formula C11H12N2O4S and molecular weight 268.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(dimethylsulfamoyl)-1H-indole-3-carboxylic acid
Also Known As: 5-(dimethylsulfamoyl)-1H-indole-3-carboxylic acid, 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)-, 5-(N,N-Dimethylsulfamoyl)-1H-indole-3-carboxylic acid, 5-Dimethylsulfamoyl-indol-3-carbonsaeure, 4-22-00-03532 (Beilstein Handbook Reference)
| Molecular Formula | C11H12N2O4S |
|---|---|
| Molecular Weight | 268.05 g/mol |
| LogP | 1.1164 |
| Topological Polar Surface Area | 90.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.0518 |
| Heavy Atoms | 18 |
| Complexity | 715.7185 |
Chemical Identifiers
| CAS Number | 120729-91-1 |
|---|---|
| SMILES | CN(C)S(=O)(=O)C1=CC2=C(C=C1)NC=C2C(=O)O |
Product Overview
1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)- (CAS 120729-91-1), with molecular formula C11H12N2O4S and molecular weight 268.05 g/mol. IUPAC: 5-(dimethylsulfamoyl)-1H-indole-3-carboxylic acid.
Chemical Property Profile of 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)-
Property Insights of 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)-
The XLogP value of 1.1164 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)-. The TPSA of 90.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)-. Following Lipinski's Rule of Five, 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)- 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 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)-?
The CAS number of 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)- is 120729-91-1.
What is the molecular formula of 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)-?
The molecular formula of 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)- is C11H12N2O4S.
What is the molecular weight of 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)-?
The molecular weight of 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)- is 268.05 g/mol.
Where can I buy 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)-?
You can request a quote for 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole-3-carboxylic acid, 5-((dimethylamino)sulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.