3-({[(2,3-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[(2,3-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
3-({[(2,3-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0992 |
| Compound Name: | 3-({[(2,3-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxylic acid |
| Molecular Weight: | 478.52 |
| Molecular Formula: | C27 H27 F N2 O5 |
| Smiles: | COc1ccc2c(CNCc3cccc(c3OC)OC)c(C(O)=O)n(Cc3ccc(cc3)F)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 4.4228 |
| logD: | 4.4228 |
| logSw: | -4.5536 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.534 |
| InChI Key: | FSUJFTQRVZEQQJ-UHFFFAOYSA-N |