2-(4-butoxyphenyl)-5-{[4-(diethylamino)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(4-butoxyphenyl)-5-{[4-(diethylamino)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(4-butoxyphenyl)-5-{[4-(diethylamino)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6187-0937 |
| Compound Name: | 2-(4-butoxyphenyl)-5-{[4-(diethylamino)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 448.59 |
| Molecular Formula: | C25 H28 N4 O2 S |
| Smiles: | CCCCOc1ccc(cc1)c1nc2n(C(/C(=C/c3ccc(cc3)N(CC)CC)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.3341 |
| logD: | 6.3323 |
| logSw: | -5.4717 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.35 |
| InChI Key: | SWKKUMHGKVWUBL-UHFFFAOYSA-N |