(6E)-6-{[4-(dimethylamino)phenyl]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-{[4-(dimethylamino)phenyl]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-{[4-(dimethylamino)phenyl]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: | 8008-5943 |
Compound Name: | (6E)-6-{[4-(dimethylamino)phenyl]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: | 524.64 |
Molecular Formula: | C29 H28 N6 O2 S |
Smiles: | CN(C)c1ccc(\C=C2/C(N3C(=NC4(c5ccccc5)C(c5ccccc5)(N3)N(C)C(N4C)=O)S2)=O)cc1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.0108 |
logD: | 5.0107 |
logSw: | -4.6138 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.216 |
InChI Key: | JETDYKDVQXDARZ-UHFFFAOYSA-N |