N-{2-[(2,6-dinitrophenyl)sulfanyl]ethyl}aniline
Chemical Structure Depiction of
N-{2-[(2,6-dinitrophenyl)sulfanyl]ethyl}aniline
N-{2-[(2,6-dinitrophenyl)sulfanyl]ethyl}aniline
Compound characteristics
| Compound ID: | 8008-4130 |
| Compound Name: | N-{2-[(2,6-dinitrophenyl)sulfanyl]ethyl}aniline |
| Molecular Weight: | 319.34 |
| Molecular Formula: | C14 H13 N3 O4 S |
| Smiles: | C(CSc1c(cccc1[N+]([O-])=O)[N+]([O-])=O)Nc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2915 |
| logD: | 3.2913 |
| logSw: | -3.5865 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.476 |
| InChI Key: | FUYNGZOHSNYPEN-UHFFFAOYSA-N |