N-[(3-chloro-4-fluorophenyl)methyl]-2-[4-(2-methylpropyl)-3,5-dioxo-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-[4-(2-methylpropyl)-3,5-dioxo-3,4-dihydro-2H-pyridazino[4,5-b][1,4]thiazin-6(5H)-yl]acetamide
N-[(3-chloro-4-fluorophenyl)methyl]-2-[4-(2-methylpropyl)-3,5-dioxo-3,4-dihydro-2H-pyridazino[4,5-b][1,4]thiazin-6(5H)-yl]acetamide
Compound characteristics
| Compound ID: | M152-1046 |
| Compound Name: | N-[(3-chloro-4-fluorophenyl)methyl]-2-[4-(2-methylpropyl)-3,5-dioxo-3,4-dihydro-2H-pyridazino[4,5-b][1,4]thiazin-6(5H)-yl]acetamide |
| Molecular Weight: | 438.91 |
| Molecular Formula: | C19 H20 Cl F N4 O3 S |
| Smiles: | CC(C)CN1C2=C(C=NN(CC(NCc3ccc(c(c3)[Cl])F)=O)C2=O)SCC1=O |
| Stereo: | ACHIRAL |
| logP: | 2.7859 |
| logD: | 2.7859 |
| logSw: | -3.4875 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.859 |
| InChI Key: | GLYYOFGQYOANJZ-UHFFFAOYSA-N |