1-[(2-methylphenyl)methyl]-3-({[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-methylphenyl)methyl]-3-({[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(2-methylphenyl)methyl]-3-({[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E693-0481 |
| Compound Name: | 1-[(2-methylphenyl)methyl]-3-({[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 474.56 |
| Molecular Formula: | C28 H30 N2 O5 |
| Smiles: | Cc1ccccc1Cn1c(C(O)=O)c(CNCc2cc(c(c(c2)OC)OC)OC)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.733 |
| logD: | 4.733 |
| logSw: | -4.5724 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.62 |
| InChI Key: | VYMSMTLEKUKCFE-UHFFFAOYSA-N |