N-(4-ethoxy-2-nitrophenyl)-2-[(1-oxophthalazin-2(1H)-yl)acetyl]hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-(4-ethoxy-2-nitrophenyl)-2-[(1-oxophthalazin-2(1H)-yl)acetyl]hydrazine-1-carbothioamide
N-(4-ethoxy-2-nitrophenyl)-2-[(1-oxophthalazin-2(1H)-yl)acetyl]hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | 8017-3246 |
| Compound Name: | N-(4-ethoxy-2-nitrophenyl)-2-[(1-oxophthalazin-2(1H)-yl)acetyl]hydrazine-1-carbothioamide |
| Molecular Weight: | 442.45 |
| Molecular Formula: | C19 H18 N6 O5 S |
| Smiles: | CCOc1ccc(c(c1)[N+]([O-])=O)NC(NNC(CN1C(c2ccccc2C=N1)=O)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 1.8187 |
| logD: | 1.3203 |
| logSw: | -2.9683 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.722 |
| InChI Key: | OMXHFDJPXWMLPV-UHFFFAOYSA-N |