3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid
3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E693-0542 |
| Compound Name: | 3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 444.53 |
| Molecular Formula: | C27 H28 N2 O4 |
| Smiles: | Cc1ccc(Cn2c(C(O)=O)c(CNCc3cc(ccc3OC)OC)c3ccccc23)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7839 |
| logD: | 4.7839 |
| logSw: | -4.5691 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.817 |
| InChI Key: | MRXUHDQNOIQXNS-UHFFFAOYSA-N |