6-{[4-(methylsulfanyl)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-(methylsulfanyl)phenyl]methylidene}-3-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
6-{[4-(methylsulfanyl)phenyl]methylidene}-3-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
Compound characteristics
| Compound ID: | 6634-0095 |
| Compound Name: | 6-{[4-(methylsulfanyl)phenyl]methylidene}-3-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one |
| Molecular Weight: | 441.53 |
| Molecular Formula: | C21 H19 N3 O4 S2 |
| Smiles: | COc1cc(cc(c1OC)OC)c1nnc2n1C(/C(=C/c1ccc(cc1)SC)S2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6762 |
| logD: | 3.6762 |
| logSw: | -4.0398 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.922 |
| InChI Key: | ARXCQEAWNNNMSZ-UHFFFAOYSA-N |