N-[(adamantan-1-yl)methyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(adamantan-1-yl)methyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
N-[(adamantan-1-yl)methyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | 8017-2082 |
| Compound Name: | N-[(adamantan-1-yl)methyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 386.41 |
| Molecular Formula: | C18 H22 N6 O4 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)CNC(c1nc(Cn2cc(cn2)[N+]([O-])=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6926 |
| logD: | 2.6926 |
| logSw: | -2.8699 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.512 |
| InChI Key: | PKAOGOSCTIMNQI-UHFFFAOYSA-N |