1-[(4-methoxyphenyl)methyl]-3-{[(2-phenylethyl)amino]methyl}-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(4-methoxyphenyl)methyl]-3-{[(2-phenylethyl)amino]methyl}-1H-indole-2-carboxylic acid
1-[(4-methoxyphenyl)methyl]-3-{[(2-phenylethyl)amino]methyl}-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0242 |
| Compound Name: | 1-[(4-methoxyphenyl)methyl]-3-{[(2-phenylethyl)amino]methyl}-1H-indole-2-carboxylic acid |
| Molecular Weight: | 414.5 |
| Molecular Formula: | C26 H26 N2 O3 |
| Smiles: | COc1ccc(Cn2c(C(O)=O)c(CNCCc3ccccc3)c3ccccc23)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0055 |
| logD: | 4.0055 |
| logSw: | -4.128 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.028 |
| InChI Key: | KFMUCAVIEMQBJL-UHFFFAOYSA-N |