3-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-6-methyl-1,2,4-triazin-5(4H)-one
Chemical Structure Depiction of
3-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-6-methyl-1,2,4-triazin-5(4H)-one
3-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-6-methyl-1,2,4-triazin-5(4H)-one
Compound characteristics
| Compound ID: | 1683-6512 |
| Compound Name: | 3-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-6-methyl-1,2,4-triazin-5(4H)-one |
| Molecular Weight: | 273.25 |
| Molecular Formula: | C12 H11 N5 O3 |
| Smiles: | CC1C(NC(N/N=C/c2ccc3c(c2)OCO3)=NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8207 |
| logD: | 1.8133 |
| logSw: | -2.3982 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.637 |
| InChI Key: | CCIYHUHUBSGVPC-UHFFFAOYSA-N |