3-[(benzylamino)methyl]-1,6-dimethyl-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-[(benzylamino)methyl]-1,6-dimethyl-1H-indole-2-carboxylic acid
3-[(benzylamino)methyl]-1,6-dimethyl-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-1378 |
| Compound Name: | 3-[(benzylamino)methyl]-1,6-dimethyl-1H-indole-2-carboxylic acid |
| Molecular Weight: | 308.38 |
| Molecular Formula: | C19 H20 N2 O2 |
| Smiles: | Cc1ccc2c(CNCc3ccccc3)c(C(O)=O)n(C)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 2.926 |
| logD: | 2.926 |
| logSw: | -3.2293 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.724 |
| InChI Key: | BMOCRAOJDCNKDG-UHFFFAOYSA-N |