N-[1-(adamantan-1-yl)propyl]-4-bromo-1,5-dimethyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)propyl]-4-bromo-1,5-dimethyl-1H-pyrazole-3-carboxamide
N-[1-(adamantan-1-yl)propyl]-4-bromo-1,5-dimethyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y500-2820 |
| Compound Name: | N-[1-(adamantan-1-yl)propyl]-4-bromo-1,5-dimethyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 394.35 |
| Molecular Formula: | C19 H28 Br N3 O |
| Smiles: | CCC(C12CC3CC(CC(C3)C2)C1)NC(c1c(c(C)n(C)n1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0027 |
| logD: | 4.0027 |
| logSw: | -4.0732 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.348 |
| InChI Key: | BXGHPRSGGJKFIE-ZBUUCQELSA-N |