3-{[6-oxo-2-{4-[(propan-2-yl)oxy]phenyl}[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
3-{[6-oxo-2-{4-[(propan-2-yl)oxy]phenyl}[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
3-{[6-oxo-2-{4-[(propan-2-yl)oxy]phenyl}[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | 4341-1289 |
| Compound Name: | 3-{[6-oxo-2-{4-[(propan-2-yl)oxy]phenyl}[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 421.47 |
| Molecular Formula: | C22 H19 N3 O4 S |
| Smiles: | CC(C)Oc1ccc(cc1)c1nc2n(C(/C(=C/c3cccc(c3)OC(C)=O)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.1257 |
| logD: | 4.1257 |
| logSw: | -4.395 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.75 |
| InChI Key: | HFJQDUCPXOGGTR-UHFFFAOYSA-N |