2-{[3-(hydroxymethyl)-2-methyl-1H-indol-1-yl]methyl}benzonitrile
Chemical Structure Depiction of
2-{[3-(hydroxymethyl)-2-methyl-1H-indol-1-yl]methyl}benzonitrile
2-{[3-(hydroxymethyl)-2-methyl-1H-indol-1-yl]methyl}benzonitrile
Compound characteristics
| Compound ID: | 8016-2480 |
| Compound Name: | 2-{[3-(hydroxymethyl)-2-methyl-1H-indol-1-yl]methyl}benzonitrile |
| Molecular Weight: | 276.34 |
| Molecular Formula: | C18 H16 N2 O |
| Smiles: | Cc1c(CO)c2ccccc2n1Cc1ccccc1C#N |
| Stereo: | ACHIRAL |
| logP: | 3.2623 |
| logD: | 3.2623 |
| logSw: | -3.2707 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.61 |
| InChI Key: | XIJNDAQJDOWYBL-UHFFFAOYSA-N |