7-methyl-4-({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-methyl-4-({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
7-methyl-4-({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L111-0189 |
| Compound Name: | 7-methyl-4-({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 389.33 |
| Molecular Formula: | C19 H14 F3 N3 O3 |
| Smiles: | Cc1ccc2c(c1)OCC(N2Cc1nc(c2cccc(c2)C(F)(F)F)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3947 |
| logD: | 4.3947 |
| logSw: | -4.5664 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.411 |
| InChI Key: | NONBZVMSDBWGGB-UHFFFAOYSA-N |