1-[(4-chlorophenyl)methyl]-3-({[(4-ethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-3-({[(4-ethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(4-chlorophenyl)methyl]-3-({[(4-ethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0209 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-3-({[(4-ethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 448.95 |
| Molecular Formula: | C26 H25 Cl N2 O3 |
| Smiles: | CCOc1ccc(CNCc2c3ccccc3n(Cc3ccc(cc3)[Cl])c2C(O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1588 |
| logD: | 5.1588 |
| logSw: | -5.2686 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.766 |
| InChI Key: | BBFDQCVDYHKKOU-UHFFFAOYSA-N |