3-({[2-(4-ethoxyphenyl)ethyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[2-(4-ethoxyphenyl)ethyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid
3-({[2-(4-ethoxyphenyl)ethyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-1734 |
| Compound Name: | 3-({[2-(4-ethoxyphenyl)ethyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C28 H29 F N2 O3 |
| Smiles: | CCOc1ccc(CCNCc2c3ccc(C)cc3n(Cc3ccc(cc3)F)c2C(O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9306 |
| logD: | 4.9306 |
| logSw: | -4.5137 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.607 |
| InChI Key: | NCXIYTVVCCGSEE-UHFFFAOYSA-N |