3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0628 |
| Compound Name: | 3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid |
| Molecular Weight: | 478.52 |
| Molecular Formula: | C27 H27 F N2 O5 |
| Smiles: | COc1ccc(c(CNCc2c3ccc(cc3n(Cc3ccccc3F)c2C(O)=O)OC)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.731 |
| logD: | 4.731 |
| logSw: | -4.6807 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.36 |
| InChI Key: | XZDFHOQDBJIQTH-UHFFFAOYSA-N |