6-chloro[1,2,4]triazolo[3,4-a]phthalazin-3(2H)-one
Chemical Structure Depiction of
6-chloro[1,2,4]triazolo[3,4-a]phthalazin-3(2H)-one
6-chloro[1,2,4]triazolo[3,4-a]phthalazin-3(2H)-one
Compound characteristics
| Compound ID: | 8012-9360 |
| Compound Name: | 6-chloro[1,2,4]triazolo[3,4-a]phthalazin-3(2H)-one |
| Molecular Weight: | 220.61 |
| Molecular Formula: | C9 H5 Cl N4 O |
| Smiles: | c1ccc2C(=NN3C(c2c1)=NNC3=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.8686 |
| logD: | -0.9625 |
| logSw: | -2.9714 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.25 |
| InChI Key: | YVJYLZHNYCZPLQ-UHFFFAOYSA-N |