6-methyl-1-[(2-methylphenyl)methyl]-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
6-methyl-1-[(2-methylphenyl)methyl]-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
6-methyl-1-[(2-methylphenyl)methyl]-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E847-0177 |
| Compound Name: | 6-methyl-1-[(2-methylphenyl)methyl]-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C25 H26 N2 O2 S |
| Smiles: | Cc1ccc2c(CNCCc3cccs3)c(C(O)=O)n(Cc3ccccc3C)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 5.2479 |
| logD: | 5.2479 |
| logSw: | -4.9188 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.502 |
| InChI Key: | VBASBEZBPTVEKH-UHFFFAOYSA-N |