[1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(diphenylmethyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(diphenylmethyl)piperazin-1-yl]methanone
[1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(diphenylmethyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | C301-3350 |
| Compound Name: | [1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(diphenylmethyl)piperazin-1-yl]methanone |
| Molecular Weight: | 525.65 |
| Molecular Formula: | C31 H35 N5 O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)n1cc(c(C(N2CCN(CC2)C(c2ccccc2)c2ccccc2)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7815 |
| logD: | 5.7799 |
| logSw: | -5.8854 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.125 |
| InChI Key: | JIVFOPPKSOHUIQ-UHFFFAOYSA-N |