N-(adamantan-1-yl)-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide
N-(adamantan-1-yl)-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide
Compound characteristics
| Compound ID: | Y502-9763 |
| Compound Name: | N-(adamantan-1-yl)-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide |
| Molecular Weight: | 332.4 |
| Molecular Formula: | C17 H24 N4 O3 |
| Smiles: | Cc1c(cnn1CCC(NC12CC3CC(CC(C3)C2)C1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3859 |
| logD: | 2.3859 |
| logSw: | -2.648 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.393 |
| InChI Key: | VSHMPQJHKCIBAJ-UHFFFAOYSA-N |