3-[(benzylamino)methyl]-1-[(2-chlorophenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-[(benzylamino)methyl]-1-[(2-chlorophenyl)methyl]-1H-indole-2-carboxylic acid
3-[(benzylamino)methyl]-1-[(2-chlorophenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-2011 |
| Compound Name: | 3-[(benzylamino)methyl]-1-[(2-chlorophenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 404.9 |
| Molecular Formula: | C24 H21 Cl N2 O2 |
| Smiles: | C(c1ccccc1)NCc1c2ccccc2n(Cc2ccccc2[Cl])c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8167 |
| logD: | 4.8167 |
| logSw: | -4.4038 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.642 |
| InChI Key: | KMLGUPYYVCICPB-UHFFFAOYSA-N |