N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C582-0778 |
| Compound Name: | N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-methyl-4-nitro-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 357.32 |
| Molecular Formula: | C16 H15 N5 O5 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(c1c(c(C)on1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6669 |
| logD: | -1.3618 |
| logSw: | -1.5098 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.722 |
| InChI Key: | OULSCIDUGUMQRI-UHFFFAOYSA-N |