6-{[4-(dimethylamino)phenyl]methylidene}-3-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
Chemical Structure Depiction of
6-{[4-(dimethylamino)phenyl]methylidene}-3-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
6-{[4-(dimethylamino)phenyl]methylidene}-3-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
Compound characteristics
Compound ID: | 6268-0711 |
Compound Name: | 6-{[4-(dimethylamino)phenyl]methylidene}-3-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one |
Molecular Weight: | 438.5 |
Molecular Formula: | C22 H22 N4 O4 S |
Smiles: | CN(C)c1ccc(/C=C2/C(n3c(c4cc(c(c(c4)OC)OC)OC)nnc3S2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.0469 |
logD: | 3.0469 |
logSw: | -3.3573 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 63.727 |
InChI Key: | HQWDOYHACMVGLV-UHFFFAOYSA-N |