6-(ethanesulfonyl)-4-({3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-(ethanesulfonyl)-4-({3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
6-(ethanesulfonyl)-4-({3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L111-0364 |
| Compound Name: | 6-(ethanesulfonyl)-4-({3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 483.42 |
| Molecular Formula: | C20 H16 F3 N3 O6 S |
| Smiles: | CCS(c1ccc2c(c1)N(Cc1nc(c3ccc(cc3)OC(F)(F)F)no1)C(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7027 |
| logD: | 3.7027 |
| logSw: | -4.1436 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 90.384 |
| InChI Key: | YWFONSOXGKYNFV-UHFFFAOYSA-N |