3-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-N-({4-[(piperidin-1-yl)methyl]phenyl}methyl)-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-N-({4-[(piperidin-1-yl)methyl]phenyl}methyl)-1,2,4-oxadiazole-5-carboxamide
3-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-N-({4-[(piperidin-1-yl)methyl]phenyl}methyl)-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | 8018-5790 |
| Compound Name: | 3-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-N-({4-[(piperidin-1-yl)methyl]phenyl}methyl)-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 439.47 |
| Molecular Formula: | C21 H25 N7 O4 |
| Smiles: | Cc1cc(nn1Cc1nc(C(NCc2ccc(CN3CCCCC3)cc2)=O)on1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.3961 |
| logD: | -0.7886 |
| logSw: | -2.3229 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 108.098 |
| InChI Key: | UJTLPLRLMRDTRE-UHFFFAOYSA-N |