6-[4-(2-chlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]pyridazin-3(2H)-one
Chemical Structure Depiction of
6-[4-(2-chlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]pyridazin-3(2H)-one
6-[4-(2-chlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | 8015-7398 |
| Compound Name: | 6-[4-(2-chlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]pyridazin-3(2H)-one |
| Molecular Weight: | 305.74 |
| Molecular Formula: | C12 H8 Cl N5 O S |
| Smiles: | C1=CC(NN=C1c1nnc(n1c1ccccc1[Cl])S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8938 |
| logD: | 1.5343 |
| logSw: | -2.5558 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.566 |
| InChI Key: | HEHXTDQXLGGPSX-UHFFFAOYSA-N |