4-methyl-1-(4-methylphenyl)-5-(2-nitrophenoxy)-N-propyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-methyl-1-(4-methylphenyl)-5-(2-nitrophenoxy)-N-propyl-1H-pyrazole-3-carboxamide
4-methyl-1-(4-methylphenyl)-5-(2-nitrophenoxy)-N-propyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V015-5786 |
| Compound Name: | 4-methyl-1-(4-methylphenyl)-5-(2-nitrophenoxy)-N-propyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 394.43 |
| Molecular Formula: | C21 H22 N4 O4 |
| Smiles: | CCCNC(c1c(C)c(n(c2ccc(C)cc2)n1)Oc1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2324 |
| logD: | 4.2324 |
| logSw: | -4.3532 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.807 |
| InChI Key: | DHFITLSJGLUOMR-UHFFFAOYSA-N |