N-(adamantan-1-yl)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide
N-(adamantan-1-yl)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | Y500-0413 |
| Compound Name: | N-(adamantan-1-yl)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 332.4 |
| Molecular Formula: | C17 H24 N4 O3 |
| Smiles: | Cc1c(c(C)n(CC(NC23CC4CC(CC(C4)C3)C2)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5326 |
| logD: | 2.5326 |
| logSw: | -2.5714 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.467 |
| InChI Key: | YWMUOJJSHQGZSV-UHFFFAOYSA-N |