N-{2-[(1H-indol-3-yl)sulfanyl]ethyl}-3-nitrobenzamide
Chemical Structure Depiction of
N-{2-[(1H-indol-3-yl)sulfanyl]ethyl}-3-nitrobenzamide
N-{2-[(1H-indol-3-yl)sulfanyl]ethyl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | C156-0211 |
| Compound Name: | N-{2-[(1H-indol-3-yl)sulfanyl]ethyl}-3-nitrobenzamide |
| Molecular Weight: | 341.39 |
| Molecular Formula: | C17 H15 N3 O3 S |
| Smiles: | C(CSc1c[nH]c2ccccc12)NC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2769 |
| logD: | 3.2769 |
| logSw: | -3.5611 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.746 |
| InChI Key: | VCMVBAPTPWBRDW-UHFFFAOYSA-N |