3-({[(2-ethoxyphenyl)methyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[(2-ethoxyphenyl)methyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid
3-({[(2-ethoxyphenyl)methyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-1718 |
| Compound Name: | 3-({[(2-ethoxyphenyl)methyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid |
| Molecular Weight: | 446.52 |
| Molecular Formula: | C27 H27 F N2 O3 |
| Smiles: | CCOc1ccccc1CNCc1c2ccc(C)cc2n(Cc2ccc(cc2)F)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3084 |
| logD: | 5.3084 |
| logSw: | -5.3212 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.853 |
| InChI Key: | XUQJUNGZMHCHOS-UHFFFAOYSA-N |