(2Z)-5-methyl-2-[(3-phenoxyphenyl)methylidene]-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
Chemical Structure Depiction of
(2Z)-5-methyl-2-[(3-phenoxyphenyl)methylidene]-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
(2Z)-5-methyl-2-[(3-phenoxyphenyl)methylidene]-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
Compound characteristics
| Compound ID: | Y502-4669 |
| Compound Name: | (2Z)-5-methyl-2-[(3-phenoxyphenyl)methylidene]-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C26 H20 N2 O3 S |
| Smiles: | CC12CC(c3ccccc3O2)N2C(=N1)SC(=C/c1cccc(c1)Oc1ccccc1)\C2=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6318 |
| logD: | 5.6313 |
| logSw: | -5.5547 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.543 |
| InChI Key: | HMLHQROXSVVVKH-UHFFFAOYSA-N |