N-(adamantan-1-yl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide
N-(adamantan-1-yl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y502-0020 |
| Compound Name: | N-(adamantan-1-yl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 338.25 |
| Molecular Formula: | C15 H20 Br N3 O |
| Smiles: | Cn1c(C(NC23CC4CC(CC(C4)C3)C2)=O)c(cn1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.9805 |
| logD: | 2.9805 |
| logSw: | -3.236 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.863 |
| InChI Key: | DXSKZMWUXZJEKY-UHFFFAOYSA-N |