5-{[4-(diethylamino)phenyl]methylidene}-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[4-(diethylamino)phenyl]methylidene}-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[4-(diethylamino)phenyl]methylidene}-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6672-0081 |
| Compound Name: | 5-{[4-(diethylamino)phenyl]methylidene}-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 476.64 |
| Molecular Formula: | C27 H32 N4 O2 S |
| Smiles: | CCCCCCOc1ccc(cc1)c1nc2n(C(/C(=C/c3ccc(cc3)N(CC)CC)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.3802 |
| logD: | 7.3784 |
| logSw: | -5.6996 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.35 |
| InChI Key: | GQHGUGOEHHTSKK-UHFFFAOYSA-N |