N-[5-(2-{2-[(4-nitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]butanamide
Chemical Structure Depiction of
N-[5-(2-{2-[(4-nitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]butanamide
N-[5-(2-{2-[(4-nitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]butanamide
Compound characteristics
| Compound ID: | 1067-0473 |
| Compound Name: | N-[5-(2-{2-[(4-nitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]butanamide |
| Molecular Weight: | 376.39 |
| Molecular Formula: | C15 H16 N6 O4 S |
| Smiles: | CCCC(Nc1nnc(CC(N/N=C/c2ccc(cc2)[N+]([O-])=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.109 |
| logD: | 2.0797 |
| logSw: | -2.825 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.912 |
| InChI Key: | CLTUIWKSRVVOBR-UHFFFAOYSA-N |