[1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
[1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
Compound characteristics
Compound ID: | C301-3327 |
Compound Name: | [1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone |
Molecular Weight: | 480.52 |
Molecular Formula: | C24 H28 N6 O5 |
Smiles: | C1C2CC3CC1CC(C2)(C3)n1cc(c(C(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)=O)n1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 4.2036 |
logD: | 4.2036 |
logSw: | -4.3082 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 101.205 |
InChI Key: | ARXBIMZMBLQSKO-UHFFFAOYSA-N |