2'-(adamantan-1-yl)-3,5,5'-trimethyl-4,4'-dinitro-2'H-1,3'-bipyrazole
Chemical Structure Depiction of
2'-(adamantan-1-yl)-3,5,5'-trimethyl-4,4'-dinitro-2'H-1,3'-bipyrazole
2'-(adamantan-1-yl)-3,5,5'-trimethyl-4,4'-dinitro-2'H-1,3'-bipyrazole
Compound characteristics
| Compound ID: | 8013-0551 |
| Compound Name: | 2'-(adamantan-1-yl)-3,5,5'-trimethyl-4,4'-dinitro-2'H-1,3'-bipyrazole |
| Molecular Weight: | 400.44 |
| Molecular Formula: | C19 H24 N6 O4 |
| Smiles: | Cc1c(c(C)n(c2c(c(C)nn2C23CC4CC(CC(C4)C3)C2)[N+]([O-])=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6877 |
| logD: | 3.6877 |
| logSw: | -4.0952 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 93.131 |
| InChI Key: | AZLQUFLNCQTHSA-UHFFFAOYSA-N |