6-methyl-1-[(4-methylphenyl)methyl]-3-{[(2-phenylethyl)amino]methyl}-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
6-methyl-1-[(4-methylphenyl)methyl]-3-{[(2-phenylethyl)amino]methyl}-1H-indole-2-carboxylic acid
6-methyl-1-[(4-methylphenyl)methyl]-3-{[(2-phenylethyl)amino]methyl}-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-1622 |
| Compound Name: | 6-methyl-1-[(4-methylphenyl)methyl]-3-{[(2-phenylethyl)amino]methyl}-1H-indole-2-carboxylic acid |
| Molecular Weight: | 412.53 |
| Molecular Formula: | C27 H28 N2 O2 |
| Smiles: | Cc1ccc(Cn2c(C(O)=O)c(CNCCc3ccccc3)c3ccc(C)cc23)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.956 |
| logD: | 4.956 |
| logSw: | -4.6188 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.484 |
| InChI Key: | XYAYVNYMSCHVOM-UHFFFAOYSA-N |