1-[(3-fluorophenyl)methyl]-3-({[(3-methoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(3-fluorophenyl)methyl]-3-({[(3-methoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(3-fluorophenyl)methyl]-3-({[(3-methoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0458 |
| Compound Name: | 1-[(3-fluorophenyl)methyl]-3-({[(3-methoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 418.47 |
| Molecular Formula: | C25 H23 F N2 O3 |
| Smiles: | COc1cccc(CNCc2c3ccccc3n(Cc3cccc(c3)F)c2C(O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.4146 |
| logD: | 4.4146 |
| logSw: | -4.3786 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.186 |
| InChI Key: | AZYZJLRXVLQQNF-UHFFFAOYSA-N |