1-[(2-chloro-4-fluorophenyl)methyl]-3-[(cycloheptylamino)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-[(cycloheptylamino)methyl]-1H-indole-2-carboxylic acid
1-[(2-chloro-4-fluorophenyl)methyl]-3-[(cycloheptylamino)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E693-0104 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-[(cycloheptylamino)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 428.93 |
| Molecular Formula: | C24 H26 Cl F N2 O2 |
| Smiles: | C1CCCC(CC1)NCc1c2ccccc2n(Cc2ccc(cc2[Cl])F)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8434 |
| logD: | 5.8434 |
| logSw: | -5.6973 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.489 |
| InChI Key: | PUCHGUWXTAHMBQ-UHFFFAOYSA-N |