1-(2,3-dimethylphenyl)-4-methyl-5-(2-nitrophenoxy)-N-propyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-(2,3-dimethylphenyl)-4-methyl-5-(2-nitrophenoxy)-N-propyl-1H-pyrazole-3-carboxamide
1-(2,3-dimethylphenyl)-4-methyl-5-(2-nitrophenoxy)-N-propyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V019-6881 |
| Compound Name: | 1-(2,3-dimethylphenyl)-4-methyl-5-(2-nitrophenoxy)-N-propyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C22 H24 N4 O4 |
| Smiles: | CCCNC(c1c(C)c(n(c2cccc(C)c2C)n1)Oc1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7037 |
| logD: | 4.7037 |
| logSw: | -4.467 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.506 |
| InChI Key: | NTSPCJRIYOBEKV-UHFFFAOYSA-N |