1-[(2-chloro-4-fluorophenyl)methyl]-3-({[2-(4-ethoxyphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-({[2-(4-ethoxyphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(2-chloro-4-fluorophenyl)methyl]-3-({[2-(4-ethoxyphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-2702 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-({[2-(4-ethoxyphenyl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 480.97 |
| Molecular Formula: | C27 H26 Cl F N2 O3 |
| Smiles: | CCOc1ccc(CCNCc2c3ccccc3n(Cc3ccc(cc3[Cl])F)c2C(O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2545 |
| logD: | 5.2545 |
| logSw: | -5.377 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.607 |
| InChI Key: | VXZSGTUXHLTSDN-UHFFFAOYSA-N |