N-{4-[4-acetyl-5-(2-hydroxy-3-methoxy-5-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]phenyl}-3-chlorobenzamide
Chemical Structure Depiction of
N-{4-[4-acetyl-5-(2-hydroxy-3-methoxy-5-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]phenyl}-3-chlorobenzamide
N-{4-[4-acetyl-5-(2-hydroxy-3-methoxy-5-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]phenyl}-3-chlorobenzamide
Compound characteristics
| Compound ID: | F076-0946 |
| Compound Name: | N-{4-[4-acetyl-5-(2-hydroxy-3-methoxy-5-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]phenyl}-3-chlorobenzamide |
| Molecular Weight: | 510.89 |
| Molecular Formula: | C24 H19 Cl N4 O7 |
| Smiles: | CC(N1C(c2cc(cc(c2O)OC)[N+]([O-])=O)OC(c2ccc(cc2)NC(c2cccc(c2)[Cl])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2029 |
| logD: | 3.8275 |
| logSw: | -4.5599 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 114.834 |
| InChI Key: | VCRBJJOFEZKHNY-XMMPIXPASA-N |