N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-[(3-nitrophenyl)methoxy]-2-oxo-1,2-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-[(3-nitrophenyl)methoxy]-2-oxo-1,2-dihydropyridine-3-carboxamide
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-[(3-nitrophenyl)methoxy]-2-oxo-1,2-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | C723-0396 |
| Compound Name: | N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-[(3-nitrophenyl)methoxy]-2-oxo-1,2-dihydropyridine-3-carboxamide |
| Molecular Weight: | 433.46 |
| Molecular Formula: | C17 H15 N5 O5 S2 |
| Smiles: | CCSc1nnc(NC(C2=CC=CN(C2=O)OCc2cccc(c2)[N+]([O-])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.3905 |
| logD: | 1.7525 |
| logSw: | -3.7791 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.552 |
| InChI Key: | QYFNCWCGOPMCKV-UHFFFAOYSA-N |