2-[3-(4-bromophenyl)-6-oxopyridazin-1(6H)-yl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)acetamide
Chemical Structure Depiction of
2-[3-(4-bromophenyl)-6-oxopyridazin-1(6H)-yl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)acetamide
2-[3-(4-bromophenyl)-6-oxopyridazin-1(6H)-yl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)acetamide
Compound characteristics
| Compound ID: | Y044-1307 |
| Compound Name: | 2-[3-(4-bromophenyl)-6-oxopyridazin-1(6H)-yl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)acetamide |
| Molecular Weight: | 426.29 |
| Molecular Formula: | C16 H16 Br N3 O4 S |
| Smiles: | C1CS(CC1NC(CN1C(C=CC(c2ccc(cc2)[Br])=N1)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0033 |
| logD: | 1.0033 |
| logSw: | -2.3005 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.181 |
| InChI Key: | KTDHIGFXZVENEB-ZDUSSCGKSA-N |