6-tert-butyl-8-{[(2,4-dimethoxyphenyl)methylidene]amino}[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
Chemical Structure Depiction of
6-tert-butyl-8-{[(2,4-dimethoxyphenyl)methylidene]amino}[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
6-tert-butyl-8-{[(2,4-dimethoxyphenyl)methylidene]amino}[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
Compound characteristics
| Compound ID: | 8012-9961 |
| Compound Name: | 6-tert-butyl-8-{[(2,4-dimethoxyphenyl)methylidene]amino}[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one |
| Molecular Weight: | 356.38 |
| Molecular Formula: | C17 H20 N6 O3 |
| Smiles: | CC(C)(C)C1C(N(c2nncn2N=1)/N=C/c1ccc(cc1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1803 |
| logD: | 2.1798 |
| logSw: | -2.7618 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.946 |
| InChI Key: | VHMXKIDJRSKKAT-UHFFFAOYSA-N |