N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-{3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetamide
Chemical Structure Depiction of
N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-{3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetamide
N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-{3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetamide
Compound characteristics
| Compound ID: | Y043-2040 |
| Compound Name: | N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-{3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetamide |
| Molecular Weight: | 441.57 |
| Molecular Formula: | C21 H23 N5 O2 S2 |
| Smiles: | CSc1ccc(cc1)C1C=CC(N(CC(Nc2nnc(C3CCCCC3)s2)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7023 |
| logD: | 4.6827 |
| logSw: | -4.2996 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.162 |
| InChI Key: | RUWIOJBJKBESKB-UHFFFAOYSA-N |