(6E)-6-[(2-bromophenyl)methylidene]-1,3-dimethyl-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione
Chemical Structure Depiction of
(6E)-6-[(2-bromophenyl)methylidene]-1,3-dimethyl-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione
(6E)-6-[(2-bromophenyl)methylidene]-1,3-dimethyl-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione
Compound characteristics
| Compound ID: | 8010-1006 |
| Compound Name: | (6E)-6-[(2-bromophenyl)methylidene]-1,3-dimethyl-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione |
| Molecular Weight: | 560.47 |
| Molecular Formula: | C27 H22 Br N5 O2 S |
| Smiles: | CN1C(N(C)C2(c3ccccc3)C1(c1ccccc1)NN1C(=N2)SC(=C\c2ccccc2[Br])\C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5717 |
| logD: | 5.5717 |
| logSw: | -5.5544 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.412 |
| InChI Key: | UJXGQTSCGXDWSB-UHFFFAOYSA-N |