N-[4-(cyanomethyl)phenyl]-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N-[4-(cyanomethyl)phenyl]-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butanamide
N-[4-(cyanomethyl)phenyl]-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | 8018-3214 |
| Compound Name: | N-[4-(cyanomethyl)phenyl]-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 422.27 |
| Molecular Formula: | C17 H19 I N4 O |
| Smiles: | Cc1c(c(C)n(CCCC(Nc2ccc(CC#N)cc2)=O)n1)I |
| Stereo: | ACHIRAL |
| logP: | 1.3932 |
| logD: | 1.3932 |
| logSw: | -1.97 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.14 |
| InChI Key: | GUMLSKFXPZIDGP-UHFFFAOYSA-N |