N-[(adamantan-1-yl)methyl]-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-[(adamantan-1-yl)methyl]-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
N-[(adamantan-1-yl)methyl]-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | 8014-9177 |
| Compound Name: | N-[(adamantan-1-yl)methyl]-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 411.3 |
| Molecular Formula: | C17 H23 Br N4 O3 |
| Smiles: | Cc1c(c(nn1CC(NCC12CC3CC(CC(C3)C2)C1)=O)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.5804 |
| logD: | 3.5804 |
| logSw: | -3.7598 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.763 |
| InChI Key: | UZEWKQRDYQFJCB-UHFFFAOYSA-N |