[4-(adamantan-1-yl)-3,5-dimethyl-1H-pyrazol-1-yl](1-methyl-4-nitro-1H-pyrazol-3-yl)methanone
Chemical Structure Depiction of
[4-(adamantan-1-yl)-3,5-dimethyl-1H-pyrazol-1-yl](1-methyl-4-nitro-1H-pyrazol-3-yl)methanone
[4-(adamantan-1-yl)-3,5-dimethyl-1H-pyrazol-1-yl](1-methyl-4-nitro-1H-pyrazol-3-yl)methanone
Compound characteristics
| Compound ID: | Y500-2816 |
| Compound Name: | [4-(adamantan-1-yl)-3,5-dimethyl-1H-pyrazol-1-yl](1-methyl-4-nitro-1H-pyrazol-3-yl)methanone |
| Molecular Weight: | 383.45 |
| Molecular Formula: | C20 H25 N5 O3 |
| Smiles: | Cc1c(c(C)n(C(c2c(cn(C)n2)[N+]([O-])=O)=O)n1)C12CC3CC(CC(C3)C2)C1 |
| Stereo: | ACHIRAL |
| logP: | 2.9075 |
| logD: | 2.9075 |
| logSw: | -3.2247 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.05 |
| InChI Key: | WAFGCTMSEIUCLH-UHFFFAOYSA-N |