[1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(2,5-dimethylphenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(2,5-dimethylphenyl)piperazin-1-yl]methanone
[1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(2,5-dimethylphenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | C301-3253 |
| Compound Name: | [1-(adamantan-1-yl)-4-nitro-1H-pyrazol-3-yl][4-(2,5-dimethylphenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 463.58 |
| Molecular Formula: | C26 H33 N5 O3 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(c1c(cn(C23CC4CC(CC(C4)C3)C2)n1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3144 |
| logD: | 5.3143 |
| logSw: | -5.306 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.523 |
| InChI Key: | HQTMEQWTRVLQNN-UHFFFAOYSA-N |