1-(4-ethylphenyl)-4-oxo-N-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,4-dihydropyridazine-3-carboxamide
Chemical Structure Depiction of
1-(4-ethylphenyl)-4-oxo-N-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,4-dihydropyridazine-3-carboxamide
1-(4-ethylphenyl)-4-oxo-N-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,4-dihydropyridazine-3-carboxamide
Compound characteristics
Compound ID: | D223-1097 |
Compound Name: | 1-(4-ethylphenyl)-4-oxo-N-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,4-dihydropyridazine-3-carboxamide |
Molecular Weight: | 401.51 |
Molecular Formula: | C18 H19 N5 O2 S2 |
Smiles: | [H]N(C(C1C(C=CN(c2ccc(CC)cc2)N=1)=O)=O)c1nnc(SCCC)s1 |
Stereo: | ACHIRAL |
logP: | 4.5529 |
logD: | 3.3494 |
logSw: | -4.227 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.646 |
InChI Key: | VGKWKTFOMBCSQH-UHFFFAOYSA-N |