2-[6-{[(4-chlorophenyl)methyl]sulfanyl}-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-[(furan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[6-{[(4-chlorophenyl)methyl]sulfanyl}-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-[(furan-2-yl)methyl]acetamide
2-[6-{[(4-chlorophenyl)methyl]sulfanyl}-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-[(furan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | F804-0077 |
| Compound Name: | 2-[6-{[(4-chlorophenyl)methyl]sulfanyl}-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-[(furan-2-yl)methyl]acetamide |
| Molecular Weight: | 429.88 |
| Molecular Formula: | C19 H16 Cl N5 O3 S |
| Smiles: | C(c1ccco1)NC(CN1C(N2C(C=CC(=N2)SCc2ccc(cc2)[Cl])=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3687 |
| logD: | 3.3687 |
| logSw: | -3.673 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.396 |
| InChI Key: | JXZUHPTZDDNBKQ-UHFFFAOYSA-N |