1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(3-methylphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(3-methylphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(3-methylphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E693-0212 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(3-methylphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 436.91 |
| Molecular Formula: | C25 H22 Cl F N2 O2 |
| Smiles: | Cc1cccc(CNCc2c3ccccc3n(Cc3ccc(cc3[Cl])F)c2C(O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.7461 |
| logD: | 5.7461 |
| logSw: | -5.6065 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.642 |
| InChI Key: | GPXAXOTWULCDHD-UHFFFAOYSA-N |