(2Z)-13-acetyl-5-methyl-2-[(quinoxalin-2-yl)methylidene]-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
Chemical Structure Depiction of
(2Z)-13-acetyl-5-methyl-2-[(quinoxalin-2-yl)methylidene]-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
(2Z)-13-acetyl-5-methyl-2-[(quinoxalin-2-yl)methylidene]-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
Compound characteristics
| Compound ID: | Y502-4671 |
| Compound Name: | (2Z)-13-acetyl-5-methyl-2-[(quinoxalin-2-yl)methylidene]-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one |
| Molecular Weight: | 442.5 |
| Molecular Formula: | C24 H18 N4 O3 S |
| Smiles: | CC(C1C2c3ccccc3OC1(C)N=C1N2C(/C(=C/c2cnc3ccccc3n2)S1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5984 |
| logD: | 3.577 |
| logSw: | -3.7503 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.169 |
| InChI Key: | RHYWQDWQPNZWEW-UHFFFAOYSA-N |