N-{3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazol-4-yl}-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-{3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazol-4-yl}-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
N-{3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazol-4-yl}-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C582-0852 |
| Compound Name: | N-{3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazol-4-yl}-5-methyl-4-nitro-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 369.38 |
| Molecular Formula: | C18 H19 N5 O4 |
| Smiles: | Cc1ccc(Cn2c(C)c(c(C)n2)NC(c2c(c(C)on2)[N+]([O-])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.0034 |
| logD: | 1.9357 |
| logSw: | -2.5488 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.227 |
| InChI Key: | CZMLZLLBGUFINU-UHFFFAOYSA-N |