3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid
3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E693-0134 |
| Compound Name: | 3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C28 H30 N2 O4 |
| Smiles: | Cc1ccc(Cn2c(C(O)=O)c(CNCCc3ccc(c(c3)OC)OC)c3ccccc23)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9635 |
| logD: | 3.9635 |
| logSw: | -4.0573 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.745 |
| InChI Key: | OOVFLVOISBFEPF-UHFFFAOYSA-N |