rel-(2Z,5R,11R)-2-[(4-fluorophenyl)methylidene]-5-methyl-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
Chemical Structure Depiction of
rel-(2Z,5R,11R)-2-[(4-fluorophenyl)methylidene]-5-methyl-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
rel-(2Z,5R,11R)-2-[(4-fluorophenyl)methylidene]-5-methyl-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
Compound characteristics
| Compound ID: | Y505-7261 |
| Compound Name: | rel-(2Z,5R,11R)-2-[(4-fluorophenyl)methylidene]-5-methyl-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one |
| Molecular Weight: | 366.41 |
| Molecular Formula: | C20 H15 F N2 O2 S |
| Smiles: | [H][C@]12C[C@@](C)(N=C3N2C(/C(=C/c2ccc(cc2)F)S3)=O)Oc2ccccc12 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.0821 |
| logD: | 4.0815 |
| logSw: | -4.429 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.795 |
| InChI Key: | OHYHHPKSANIMAK-QRWLVFNGSA-N |