2-[6-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(2-methoxy-5-methylphenyl)acetamide
Chemical Structure Depiction of
2-[6-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(2-methoxy-5-methylphenyl)acetamide
2-[6-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(2-methoxy-5-methylphenyl)acetamide
Compound characteristics
| Compound ID: | F804-0220 |
| Compound Name: | 2-[6-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(2-methoxy-5-methylphenyl)acetamide |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C21 H25 N5 O3 S |
| Smiles: | Cc1ccc(c(c1)NC(CN1C(N2C(C=CC(=N2)SC2CCCCC2)=N1)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.1057 |
| logD: | 4.1057 |
| logSw: | -4.2222 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.45 |
| InChI Key: | ZKFHGLOTGRTSRB-UHFFFAOYSA-N |