rel-(2Z,5R,11R)-2-[(furan-2-yl)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-[(furan-2-yl)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-[(furan-2-yl)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: | Y505-7188 |
Compound Name: | rel-(2Z,5R,11R)-2-[(furan-2-yl)methylidene]-5-methyl-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one |
Molecular Weight: | 338.38 |
Molecular Formula: | C18 H14 N2 O3 S |
Smiles: | [H][C@]12C[C@@](C)(N=C3N2C(/C(=C/c2ccco2)S3)=O)Oc2ccccc12 |
Stereo: | RELATIVE |
logP: | 3.3135 |
logD: | 3.3133 |
logSw: | -3.7176 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 40.544 |
InChI Key: | HOGBRSMHPBWVPG-ACJLOTCBSA-N |