2-(5-{[4-(acetyloxy)phenyl]methylidene}-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)phenyl acetate
Chemical Structure Depiction of
2-(5-{[4-(acetyloxy)phenyl]methylidene}-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)phenyl acetate
2-(5-{[4-(acetyloxy)phenyl]methylidene}-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)phenyl acetate
Compound characteristics
| Compound ID: | 4428-0005 |
| Compound Name: | 2-(5-{[4-(acetyloxy)phenyl]methylidene}-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)phenyl acetate |
| Molecular Weight: | 421.43 |
| Molecular Formula: | C21 H15 N3 O5 S |
| Smiles: | CC(=O)Oc1ccc(/C=C2/C(n3c(nc(c4ccccc4OC(C)=O)n3)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8783 |
| logD: | 2.8783 |
| logSw: | -3.6 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.785 |
| InChI Key: | RRWJMYSCHFSKRR-UHFFFAOYSA-N |