N-[2-(3-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1H-indol-1-yl)ethyl]-4-methoxybenzamide
Chemical Structure Depiction of
N-[2-(3-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1H-indol-1-yl)ethyl]-4-methoxybenzamide
N-[2-(3-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1H-indol-1-yl)ethyl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | C064-0012 |
| Compound Name: | N-[2-(3-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1H-indol-1-yl)ethyl]-4-methoxybenzamide |
| Molecular Weight: | 444.6 |
| Molecular Formula: | C27 H28 N2 O2 S |
| Smiles: | Cc1ccc(C)c(CSc2cn(CCNC(c3ccc(cc3)OC)=O)c3ccccc23)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.9025 |
| logD: | 5.9025 |
| logSw: | -5.5506 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.748 |
| InChI Key: | MCJAMWVIGKSOGN-UHFFFAOYSA-N |