1-(4-ethylphenyl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-oxo-1,4-dihydropyridazine-3-carboxamide
Chemical Structure Depiction of
1-(4-ethylphenyl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-oxo-1,4-dihydropyridazine-3-carboxamide
1-(4-ethylphenyl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-oxo-1,4-dihydropyridazine-3-carboxamide
Compound characteristics
Compound ID: | D223-1096 |
Compound Name: | 1-(4-ethylphenyl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-oxo-1,4-dihydropyridazine-3-carboxamide |
Molecular Weight: | 373.45 |
Molecular Formula: | C16 H15 N5 O2 S2 |
Smiles: | [H]N(C(C1C(C=CN(c2ccc(CC)cc2)N=1)=O)=O)c1nnc(SC)s1 |
Stereo: | ACHIRAL |
logP: | 3.8501 |
logD: | 2.6466 |
logSw: | -3.8615 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.646 |
InChI Key: | JSGWAKXNVPGHKH-UHFFFAOYSA-N |