2-(morpholin-4-yl)-N-(5-{[2-(4-nitroanilino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
2-(morpholin-4-yl)-N-(5-{[2-(4-nitroanilino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
2-(morpholin-4-yl)-N-(5-{[2-(4-nitroanilino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | 8008-7032 |
| Compound Name: | 2-(morpholin-4-yl)-N-(5-{[2-(4-nitroanilino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 438.48 |
| Molecular Formula: | C16 H18 N6 O5 S2 |
| Smiles: | C1COCCN1CC(Nc1nnc(SCC(Nc2ccc(cc2)[N+]([O-])=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2863 |
| logD: | 2.2841 |
| logSw: | -2.7471 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 114.194 |
| InChI Key: | LBZBVPZHOUIVAD-UHFFFAOYSA-N |