1-[(2-chloro-4-fluorophenyl)methyl]-6-methoxy-3-{[(4-methylcyclohexyl)amino]methyl}-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-6-methoxy-3-{[(4-methylcyclohexyl)amino]methyl}-1H-indole-2-carboxylic acid
1-[(2-chloro-4-fluorophenyl)methyl]-6-methoxy-3-{[(4-methylcyclohexyl)amino]methyl}-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0668 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-6-methoxy-3-{[(4-methylcyclohexyl)amino]methyl}-1H-indole-2-carboxylic acid |
| Molecular Weight: | 458.96 |
| Molecular Formula: | C25 H28 Cl F N2 O3 |
| Smiles: | CC1CCC(CC1)NCc1c2ccc(cc2n(Cc2ccc(cc2[Cl])F)c1C(O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 6.2483 |
| logD: | 6.2483 |
| logSw: | -5.7914 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.702 |
| InChI Key: | TZCZKQYMIKUVFU-UHFFFAOYSA-N |