3-{5-[(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-1,2,4-oxadiazol-3-yl}-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
3-{5-[(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-1,2,4-oxadiazol-3-yl}-N-(propan-2-yl)benzamide
3-{5-[(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-1,2,4-oxadiazol-3-yl}-N-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | F545-1992 |
| Compound Name: | 3-{5-[(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-1,2,4-oxadiazol-3-yl}-N-(propan-2-yl)benzamide |
| Molecular Weight: | 426.86 |
| Molecular Formula: | C21 H19 Cl N4 O4 |
| Smiles: | CC(C)NC(c1cccc(c1)c1nc(CN2C(COc3ccc(cc23)[Cl])=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3689 |
| logD: | 3.3689 |
| logSw: | -3.9163 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.07 |
| InChI Key: | RJHAOXSYNFKLHR-UHFFFAOYSA-N |