N-[5-(2-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]acetamide
Chemical Structure Depiction of
N-[5-(2-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]acetamide
N-[5-(2-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]acetamide
Compound characteristics
Compound ID: | 1067-0769 |
Compound Name: | N-[5-(2-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]acetamide |
Molecular Weight: | 348.34 |
Molecular Formula: | C13 H12 N6 O4 S |
Smiles: | CC(Nc1nnc(CC(N/N=C/c2cccc(c2)[N+]([O-])=O)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 1.39 |
logD: | 1.3793 |
logSw: | -2.4843 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 116.024 |
InChI Key: | LBYQPDKMYRBEPQ-UHFFFAOYSA-N |