4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(pyridin-3-yl)butanamide
Chemical Structure Depiction of
4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(pyridin-3-yl)butanamide
4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(pyridin-3-yl)butanamide
Compound characteristics
| Compound ID: | C163-0243 |
| Compound Name: | 4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(pyridin-3-yl)butanamide |
| Molecular Weight: | 303.32 |
| Molecular Formula: | C14 H17 N5 O3 |
| Smiles: | Cc1c(c(C)n(CCCC(Nc2cccnc2)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.354 |
| logD: | 0.3537 |
| logSw: | -1.1464 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.946 |
| InChI Key: | QQRQEFAMCSQAQC-UHFFFAOYSA-N |