3-({[(2-bromophenyl)methyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[(2-bromophenyl)methyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
3-({[(2-bromophenyl)methyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0980 |
| Compound Name: | 3-({[(2-bromophenyl)methyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid |
| Molecular Weight: | 497.36 |
| Molecular Formula: | C25 H22 Br F N2 O3 |
| Smiles: | COc1ccc2c(CNCc3ccccc3[Br])c(C(O)=O)n(Cc3ccc(cc3)F)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 5.1539 |
| logD: | 5.1539 |
| logSw: | -5.0708 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.186 |
| InChI Key: | YZUWGVSPOYJLOO-UHFFFAOYSA-N |