N-[(adamantan-1-yl)methyl]-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide
Chemical Structure Depiction of
N-[(adamantan-1-yl)methyl]-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide
N-[(adamantan-1-yl)methyl]-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide
Compound characteristics
| Compound ID: | Y502-8779 |
| Compound Name: | N-[(adamantan-1-yl)methyl]-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide |
| Molecular Weight: | 346.43 |
| Molecular Formula: | C18 H26 N4 O3 |
| Smiles: | Cc1c(cnn1CCC(NCC12CC3CC(CC(C3)C2)C1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0487 |
| logD: | 3.0487 |
| logSw: | -3.3314 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.731 |
| InChI Key: | KVJHBVAUESNMLZ-UHFFFAOYSA-N |