N-methyl-4-({[2-(4-nitrophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)-N-phenylbenzamide
Chemical Structure Depiction of
N-methyl-4-({[2-(4-nitrophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)-N-phenylbenzamide
N-methyl-4-({[2-(4-nitrophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)-N-phenylbenzamide
Compound characteristics
| Compound ID: | K091-0105 |
| Compound Name: | N-methyl-4-({[2-(4-nitrophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)-N-phenylbenzamide |
| Molecular Weight: | 442.43 |
| Molecular Formula: | C24 H18 N4 O5 |
| Smiles: | CN(C(c1ccc(cc1)N\C=C1/C(=O)OC(c2ccc(cc2)[N+]([O-])=O)=N1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3282 |
| logD: | 3.325 |
| logSw: | -3.8675 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.727 |
| InChI Key: | ATHPSGRKSXQZKW-UHFFFAOYSA-N |