5-{[2-(pentyloxy)phenyl]methylidene}-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[2-(pentyloxy)phenyl]methylidene}-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[2-(pentyloxy)phenyl]methylidene}-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5606-3983 |
| Compound Name: | 5-{[2-(pentyloxy)phenyl]methylidene}-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C22 H21 N3 O2 S |
| Smiles: | CCCCCOc1ccccc1/C=C1/C(n2c(nc(c3ccccc3)n2)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3294 |
| logD: | 6.3294 |
| logSw: | -5.432 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.7 |
| InChI Key: | NKSSGVPGYLADCB-UHFFFAOYSA-N |