5-{[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene}-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene}-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene}-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-1017 |
| Compound Name: | 5-{[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene}-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C20 H19 N3 O3 S2 |
| Smiles: | [H]C(=C1/C(n2c(nc(c3cccs3)n2)S1)=O)\c1ccc(c(c1)OC)OCC(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.9434 |
| logD: | 4.9434 |
| logSw: | -4.7167 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.431 |
| InChI Key: | PULIIXIHYNMIBA-UHFFFAOYSA-N |