N-[(3-chloro-4-fluorophenyl)methyl]-2-[3,5-dioxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-pyridazino[4,5-b][1,4]thiazin-6(5H)-yl]acetamide
Chemical Structure Depiction of
N-[(3-chloro-4-fluorophenyl)methyl]-2-[3,5-dioxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-pyridazino[4,5-b][1,4]thiazin-6(5H)-yl]acetamide
N-[(3-chloro-4-fluorophenyl)methyl]-2-[3,5-dioxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-pyridazino[4,5-b][1,4]thiazin-6(5H)-yl]acetamide
Compound characteristics
| Compound ID: | M152-1667 |
| Compound Name: | N-[(3-chloro-4-fluorophenyl)methyl]-2-[3,5-dioxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-pyridazino[4,5-b][1,4]thiazin-6(5H)-yl]acetamide |
| Molecular Weight: | 422.86 |
| Molecular Formula: | C18 H16 Cl F N4 O3 S |
| Smiles: | C=CCN1C2=C(C=NN(CC(NCc3ccc(c(c3)[Cl])F)=O)C2=O)SCC1=O |
| Stereo: | ACHIRAL |
| logP: | 2.0305 |
| logD: | 2.0305 |
| logSw: | -2.9168 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.837 |
| InChI Key: | UFUFGZAVZWWZSY-UHFFFAOYSA-N |