N-(1-methylpiperidin-4-yl)-1-[(2-nitrophenoxy)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(1-methylpiperidin-4-yl)-1-[(2-nitrophenoxy)methyl]-1H-pyrazole-3-carboxamide
N-(1-methylpiperidin-4-yl)-1-[(2-nitrophenoxy)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-6794 |
| Compound Name: | N-(1-methylpiperidin-4-yl)-1-[(2-nitrophenoxy)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 359.38 |
| Molecular Formula: | C17 H21 N5 O4 |
| Smiles: | CN1CCC(CC1)NC(c1ccn(COc2ccccc2[N+]([O-])=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.064 |
| logD: | -1.3544 |
| logSw: | -2.0641 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.384 |
| InChI Key: | QALAXHYWOBWCBN-UHFFFAOYSA-N |