8-methoxy-3-[2-({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-methoxy-3-[2-({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
8-methoxy-3-[2-({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | M040-1121 |
| Compound Name: | 8-methoxy-3-[2-({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 485.44 |
| Molecular Formula: | C23 H14 F3 N3 O4 S |
| Smiles: | COc1cccc2C=C(C(=O)Oc12)c1csc(Cc2nc(c3ccc(cc3)C(F)(F)F)no2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7761 |
| logD: | 5.7761 |
| logSw: | -5.6533 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.775 |
| InChI Key: | FPBKKPGYEKXKRM-UHFFFAOYSA-N |