N-(2H-1,3-benzodioxol-5-yl)-2-{[1-(4-nitrophenyl)-1H-imidazol-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-{[1-(4-nitrophenyl)-1H-imidazol-2-yl]sulfanyl}acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-{[1-(4-nitrophenyl)-1H-imidazol-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G856-1944 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-{[1-(4-nitrophenyl)-1H-imidazol-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 398.4 |
| Molecular Formula: | C18 H14 N4 O5 S |
| Smiles: | C1Oc2ccc(cc2O1)NC(CSc1nccn1c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1635 |
| logD: | 3.1624 |
| logSw: | -3.442 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.164 |
| InChI Key: | JYOUTFYCAJVBET-UHFFFAOYSA-N |