1-(2,3-dimethylphenyl)-N-(2-methoxyethyl)-4-methyl-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-(2,3-dimethylphenyl)-N-(2-methoxyethyl)-4-methyl-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide
1-(2,3-dimethylphenyl)-N-(2-methoxyethyl)-4-methyl-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V017-1418 |
| Compound Name: | 1-(2,3-dimethylphenyl)-N-(2-methoxyethyl)-4-methyl-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 424.46 |
| Molecular Formula: | C22 H24 N4 O5 |
| Smiles: | Cc1cccc(c1C)n1c(c(C)c(C(NCCOC)=O)n1)Oc1ccccc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9708 |
| logD: | 3.9708 |
| logSw: | -4.2376 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.849 |
| InChI Key: | IOLZGRMDRVFGTD-UHFFFAOYSA-N |