1-methyl-3-({[2-(4-sulfamoylphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-methyl-3-({[2-(4-sulfamoylphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
1-methyl-3-({[2-(4-sulfamoylphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
Compound ID: | C753-0631 |
Compound Name: | 1-methyl-3-({[2-(4-sulfamoylphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid |
Molecular Weight: | 387.46 |
Molecular Formula: | C19 H21 N3 O4 S |
Smiles: | Cn1c(C(O)=O)c(CNCCc2ccc(cc2)S(N)(=O)=O)c2ccccc12 |
Stereo: | ACHIRAL |
logP: | 0.5092 |
logD: | 0.5092 |
logSw: | -2.1388 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 92.169 |
InChI Key: | OCWVACLAMFDANJ-UHFFFAOYSA-N |