9-(2,3-dimethoxyphenyl)-5-[(2,3-dimethoxyphenyl)methylidene]-4,5,6,7,8,9-hexahydro[1,2,4]triazolo[5,1-b]quinazoline
Chemical Structure Depiction of
9-(2,3-dimethoxyphenyl)-5-[(2,3-dimethoxyphenyl)methylidene]-4,5,6,7,8,9-hexahydro[1,2,4]triazolo[5,1-b]quinazoline
9-(2,3-dimethoxyphenyl)-5-[(2,3-dimethoxyphenyl)methylidene]-4,5,6,7,8,9-hexahydro[1,2,4]triazolo[5,1-b]quinazoline
Compound characteristics
| Compound ID: | K832-3671 |
| Compound Name: | 9-(2,3-dimethoxyphenyl)-5-[(2,3-dimethoxyphenyl)methylidene]-4,5,6,7,8,9-hexahydro[1,2,4]triazolo[5,1-b]quinazoline |
| Molecular Weight: | 460.53 |
| Molecular Formula: | C26 H28 N4 O4 |
| Smiles: | COc1cccc(\C=C2/CCCC3C(c4cccc(c4OC)OC)n4c(NC2=3)ncn4)c1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.519 |
| logD: | 4.519 |
| logSw: | -4.4808 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.891 |
| InChI Key: | GVUHAWSWBCXULQ-HSZRJFAPSA-N |