1-[(2-chloro-4-fluorophenyl)methyl]-3-[({2-[ethyl(phenyl)amino]ethyl}amino)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-[({2-[ethyl(phenyl)amino]ethyl}amino)methyl]-1H-indole-2-carboxylic acid
1-[(2-chloro-4-fluorophenyl)methyl]-3-[({2-[ethyl(phenyl)amino]ethyl}amino)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-2695 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-[({2-[ethyl(phenyl)amino]ethyl}amino)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 479.98 |
| Molecular Formula: | C27 H27 Cl F N3 O2 |
| Smiles: | CCN(CCNCc1c2ccccc2n(Cc2ccc(cc2[Cl])F)c1C(O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5836 |
| logD: | 5.5836 |
| logSw: | -5.5558 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.474 |
| InChI Key: | MXWSMVDVUWWRST-UHFFFAOYSA-N |