5-{[2-(pentyloxy)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[2-(pentyloxy)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[2-(pentyloxy)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5606-3982 |
| Compound Name: | 5-{[2-(pentyloxy)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 315.39 |
| Molecular Formula: | C16 H17 N3 O2 S |
| Smiles: | CCCCCOc1ccccc1\C=C1/C(n2c(ncn2)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2499 |
| logD: | 4.2499 |
| logSw: | -4.2646 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.913 |
| InChI Key: | SFUKNSYLMPWUKV-UHFFFAOYSA-N |