N-{2-[3-(benzylsulfanyl)-1H-indol-1-yl]ethyl}-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-{2-[3-(benzylsulfanyl)-1H-indol-1-yl]ethyl}-3,4-dimethoxybenzamide
N-{2-[3-(benzylsulfanyl)-1H-indol-1-yl]ethyl}-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | C064-0460 |
| Compound Name: | N-{2-[3-(benzylsulfanyl)-1H-indol-1-yl]ethyl}-3,4-dimethoxybenzamide |
| Molecular Weight: | 446.57 |
| Molecular Formula: | C26 H26 N2 O3 S |
| Smiles: | COc1ccc(cc1OC)C(NCCn1cc(c2ccccc12)SCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0393 |
| logD: | 4.0393 |
| logSw: | -4.0445 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.465 |
| InChI Key: | SIRJANRWDKASEX-UHFFFAOYSA-N |