1-[(2-fluorophenyl)methyl]-6-methyl-3-({[2-(4-methylphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-fluorophenyl)methyl]-6-methyl-3-({[2-(4-methylphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(2-fluorophenyl)methyl]-6-methyl-3-({[2-(4-methylphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E847-0208 |
| Compound Name: | 1-[(2-fluorophenyl)methyl]-6-methyl-3-({[2-(4-methylphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C27 H27 F N2 O2 |
| Smiles: | Cc1ccc(CCNCc2c3ccc(C)cc3n(Cc3ccccc3F)c2C(O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.234 |
| logD: | 5.234 |
| logSw: | -4.9861 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.484 |
| InChI Key: | CYKKYRFJAPKRHV-UHFFFAOYSA-N |