2-[3,5-dioxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-pyridazino[4,5-b][1,4]thiazin-6(5H)-yl]-N-{[4-(trifluoromethyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-[3,5-dioxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-pyridazino[4,5-b][1,4]thiazin-6(5H)-yl]-N-{[4-(trifluoromethyl)phenyl]methyl}acetamide
2-[3,5-dioxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-pyridazino[4,5-b][1,4]thiazin-6(5H)-yl]-N-{[4-(trifluoromethyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | M152-1653 |
| Compound Name: | 2-[3,5-dioxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-pyridazino[4,5-b][1,4]thiazin-6(5H)-yl]-N-{[4-(trifluoromethyl)phenyl]methyl}acetamide |
| Molecular Weight: | 438.43 |
| Molecular Formula: | C19 H17 F3 N4 O3 S |
| Smiles: | C=CCN1C2=C(C=NN(CC(NCc3ccc(cc3)C(F)(F)F)=O)C2=O)SCC1=O |
| Stereo: | ACHIRAL |
| logP: | 2.2884 |
| logD: | 2.2884 |
| logSw: | -2.644 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.837 |
| InChI Key: | ZBXCKDFBBPCYKR-UHFFFAOYSA-N |