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
3-[2-({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
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: | M040-0608 |
| Compound Name: | 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: | 455.41 |
| Molecular Formula: | C22 H12 F3 N3 O3 S |
| Smiles: | C(c1nc(c2ccc(cc2)C(F)(F)F)no1)c1nc(cs1)C1=Cc2ccccc2OC1=O |
| Stereo: | ACHIRAL |
| logP: | 5.8273 |
| logD: | 5.8273 |
| logSw: | -6.132 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.461 |
| InChI Key: | UDTTZLVNQHXXPF-UHFFFAOYSA-N |