1-[(3-fluorophenyl)methyl]-3-({[(3-fluorophenyl)methyl]amino}methyl)-6-methyl-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(3-fluorophenyl)methyl]-3-({[(3-fluorophenyl)methyl]amino}methyl)-6-methyl-1H-indole-2-carboxylic acid
1-[(3-fluorophenyl)methyl]-3-({[(3-fluorophenyl)methyl]amino}methyl)-6-methyl-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E847-0259 |
| Compound Name: | 1-[(3-fluorophenyl)methyl]-3-({[(3-fluorophenyl)methyl]amino}methyl)-6-methyl-1H-indole-2-carboxylic acid |
| Molecular Weight: | 420.46 |
| Molecular Formula: | C25 H22 F2 N2 O2 |
| Smiles: | Cc1ccc2c(CNCc3cccc(c3)F)c(C(O)=O)n(Cc3cccc(c3)F)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 4.9908 |
| logD: | 4.9908 |
| logSw: | -4.6486 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.642 |
| InChI Key: | VSSVUYXPKQCFHC-UHFFFAOYSA-N |