3-({[(3-chlorophenyl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[(3-chlorophenyl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
3-({[(3-chlorophenyl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0572 |
| Compound Name: | 3-({[(3-chlorophenyl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid |
| Molecular Weight: | 452.91 |
| Molecular Formula: | C25 H22 Cl F N2 O3 |
| Smiles: | COc1ccc2c(CNCc3cccc(c3)[Cl])c(C(O)=O)n(Cc3ccccc3F)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 5.2629 |
| logD: | 5.2629 |
| logSw: | -5.4558 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.186 |
| InChI Key: | GNKZCVCWBMLSJX-UHFFFAOYSA-N |