3-({[(2H-1,3-benzodioxol-5-yl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[(2H-1,3-benzodioxol-5-yl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid
3-({[(2H-1,3-benzodioxol-5-yl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-2328 |
| Compound Name: | 3-({[(2H-1,3-benzodioxol-5-yl)methyl]amino}methyl)-1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 432.45 |
| Molecular Formula: | C25 H21 F N2 O4 |
| Smiles: | C(c1ccc2c(c1)OCO2)NCc1c2ccccc2n(Cc2ccccc2F)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3863 |
| logD: | 4.3863 |
| logSw: | -4.3983 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.758 |
| InChI Key: | NPRNYKACWMMPSO-UHFFFAOYSA-N |