2-methyl-6H-[1]benzopyrano[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6-one
Chemical Structure Depiction of
2-methyl-6H-[1]benzopyrano[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6-one
2-methyl-6H-[1]benzopyrano[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6-one
Compound characteristics
| Compound ID: | Y021-2957 |
| Compound Name: | 2-methyl-6H-[1]benzopyrano[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6-one |
| Molecular Weight: | 253.22 |
| Molecular Formula: | C12 H7 N5 O2 |
| Smiles: | Cc1nc2N=NC3=C(c4ccccc4OC3=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 2.11 |
| logD: | 1.9839 |
| logSw: | -2.8353 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.198 |
| InChI Key: | MLEGUJZOMXPDOB-UHFFFAOYSA-N |