3-({[(4-ethoxyphenyl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[(4-ethoxyphenyl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid
3-({[(4-ethoxyphenyl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0062 |
| Compound Name: | 3-({[(4-ethoxyphenyl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 432.49 |
| Molecular Formula: | C26 H25 F N2 O3 |
| Smiles: | CCOc1ccc(CNCc2c3ccccc3n(Cc3ccccc3F)c2C(O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8421 |
| logD: | 4.8421 |
| logSw: | -4.4036 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.766 |
| InChI Key: | JBVFUZWMUPPEAR-UHFFFAOYSA-N |