2-methyl-N-{2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl}-3-nitrobenzamide
Chemical Structure Depiction of
2-methyl-N-{2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl}-3-nitrobenzamide
2-methyl-N-{2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | C156-0227 |
| Compound Name: | 2-methyl-N-{2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl}-3-nitrobenzamide |
| Molecular Weight: | 369.44 |
| Molecular Formula: | C19 H19 N3 O3 S |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)C(NCCSc1c2ccccc2[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7771 |
| logD: | 3.7771 |
| logSw: | -4.2078 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.5 |
| InChI Key: | OYXSXIJKOMLVJQ-UHFFFAOYSA-N |