[1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone
[1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | C301-3333 |
| Compound Name: | [1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 453.52 |
| Molecular Formula: | C24 H28 F N5 O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)n1cc(c(C(N2CCN(CC2)c2ccccc2F)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3349 |
| logD: | 4.3349 |
| logSw: | -4.3839 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.523 |
| InChI Key: | RTHSTLDDWKLBFH-UHFFFAOYSA-N |