N-[5-(2-{2-[(4-nitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]propanamide
Chemical Structure Depiction of
N-[5-(2-{2-[(4-nitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]propanamide
N-[5-(2-{2-[(4-nitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]propanamide
Compound characteristics
| Compound ID: | 1067-0805 |
| Compound Name: | N-[5-(2-{2-[(4-nitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]propanamide |
| Molecular Weight: | 362.36 |
| Molecular Formula: | C14 H14 N6 O4 S |
| Smiles: | CCC(Nc1nnc(CC(N/N=C/c2ccc(cc2)[N+]([O-])=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6318 |
| logD: | 1.6129 |
| logSw: | -2.4963 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.912 |
| InChI Key: | JUMUBIJMVJOMEL-UHFFFAOYSA-N |