2-[4-(hexyloxy)phenyl]-5-[(5-methylfuran-2-yl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-[4-(hexyloxy)phenyl]-5-[(5-methylfuran-2-yl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-[4-(hexyloxy)phenyl]-5-[(5-methylfuran-2-yl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6672-0099 |
| Compound Name: | 2-[4-(hexyloxy)phenyl]-5-[(5-methylfuran-2-yl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C22 H23 N3 O3 S |
| Smiles: | CCCCCCOc1ccc(cc1)c1nc2n(C(/C(=C/c3ccc(C)o3)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.4131 |
| logD: | 6.4131 |
| logSw: | -5.5422 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.877 |
| InChI Key: | ZMTDULZKQWVYNO-UHFFFAOYSA-N |