6-chloro-4-({3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-4-({3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
6-chloro-4-({3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L111-0148 |
| Compound Name: | 6-chloro-4-({3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 425.75 |
| Molecular Formula: | C18 H11 Cl F3 N3 O4 |
| Smiles: | C(c1nc(c2ccc(cc2)OC(F)(F)F)no1)N1C(COc2ccc(cc12)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8499 |
| logD: | 4.8499 |
| logSw: | -5.0305 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.348 |
| InChI Key: | IOYKKRRTOILRML-UHFFFAOYSA-N |