2-[3-(adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl]-5-(3-nitrophenyl)-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[3-(adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl]-5-(3-nitrophenyl)-1,3,4-oxadiazole
2-[3-(adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl]-5-(3-nitrophenyl)-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | 8018-0655 |
| Compound Name: | 2-[3-(adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl]-5-(3-nitrophenyl)-1,3,4-oxadiazole |
| Molecular Weight: | 467.53 |
| Molecular Formula: | C27 H25 N5 O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)c1c(cn(c2ccccc2)n1)c1nnc(c2cccc(c2)[N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 6.4368 |
| logD: | 6.4368 |
| logSw: | -6.4223 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 78.53 |
| InChI Key: | LKMAKAZYDJZGCK-UHFFFAOYSA-N |