N-[2-(adamantan-1-yl)ethyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(adamantan-1-yl)ethyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
N-[2-(adamantan-1-yl)ethyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | 8018-4475 |
| Compound Name: | N-[2-(adamantan-1-yl)ethyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 400.44 |
| Molecular Formula: | C19 H24 N6 O4 |
| Smiles: | C1C2CC3CC1CC(CCNC(c1nc(Cn4cc(cn4)[N+]([O-])=O)no1)=O)(C2)C3 |
| Stereo: | ACHIRAL |
| logP: | 2.541 |
| logD: | 2.541 |
| logSw: | -2.5886 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.353 |
| InChI Key: | KFHJUFYOCMLXMX-UHFFFAOYSA-N |