1-benzyl-6-methyl-3-{[({4-[(propan-2-yl)oxy]phenyl}methyl)amino]methyl}-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-benzyl-6-methyl-3-{[({4-[(propan-2-yl)oxy]phenyl}methyl)amino]methyl}-1H-indole-2-carboxylic acid
1-benzyl-6-methyl-3-{[({4-[(propan-2-yl)oxy]phenyl}methyl)amino]methyl}-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-1598 |
| Compound Name: | 1-benzyl-6-methyl-3-{[({4-[(propan-2-yl)oxy]phenyl}methyl)amino]methyl}-1H-indole-2-carboxylic acid |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C28 H30 N2 O3 |
| Smiles: | CC(C)Oc1ccc(CNCc2c3ccc(C)cc3n(Cc3ccccc3)c2C(O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3711 |
| logD: | 5.3711 |
| logSw: | -5.4399 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.445 |
| InChI Key: | HHZFHRHOLCJRDA-UHFFFAOYSA-N |