N-[3-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]-2-(1-oxophthalazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[3-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]-2-(1-oxophthalazin-2(1H)-yl)acetamide
N-[3-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]-2-(1-oxophthalazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | Y043-2163 |
| Compound Name: | N-[3-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]-2-(1-oxophthalazin-2(1H)-yl)acetamide |
| Molecular Weight: | 412.47 |
| Molecular Formula: | C20 H20 N4 O4 S |
| Smiles: | C1CCS(N(C1)c1cccc(c1)NC(CN1C(c2ccccc2C=N1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2523 |
| logD: | 1.2522 |
| logSw: | -2.6653 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.049 |
| InChI Key: | SMEHKSLDWCXMOA-UHFFFAOYSA-N |