1-(adamantan-1-yl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Chemical Structure Depiction of
1-(adamantan-1-yl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
1-(adamantan-1-yl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y501-8821 |
| Compound Name: | 1-(adamantan-1-yl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one |
| Molecular Weight: | 284.4 |
| Molecular Formula: | C18 H24 N2 O |
| Smiles: | Cc1c(/C=C/C(C23CC4CC(CC(C4)C3)C2)=O)cnn1C |
| Stereo: | ACHIRAL |
| logP: | 3.8582 |
| logD: | 3.8582 |
| logSw: | -3.95 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 27.7335 |
| InChI Key: | PRXBAPUGJXTDBN-UHFFFAOYSA-N |