N-(4-cyanophenyl)-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(4-cyanophenyl)-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
N-(4-cyanophenyl)-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C582-0875 |
| Compound Name: | N-(4-cyanophenyl)-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 300.27 |
| Molecular Formula: | C14 H12 N4 O4 |
| Smiles: | CC(C)c1c(c(C(Nc2ccc(C#N)cc2)=O)no1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7272 |
| logD: | 2.4578 |
| logSw: | -3.4761 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.976 |
| InChI Key: | ZVDDAVAHLOOQBK-UHFFFAOYSA-N |