3-[(cyclooctylamino)methyl]-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-[(cyclooctylamino)methyl]-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
3-[(cyclooctylamino)methyl]-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0582 |
| Compound Name: | 3-[(cyclooctylamino)methyl]-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid |
| Molecular Weight: | 438.54 |
| Molecular Formula: | C26 H31 F N2 O3 |
| Smiles: | COc1ccc2c(CNC3CCCCCCC3)c(C(O)=O)n(Cc3ccccc3F)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 5.8473 |
| logD: | 5.8473 |
| logSw: | -5.5068 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.033 |
| InChI Key: | WPBUWUYKYAPKEN-UHFFFAOYSA-N |