N-[4-(cyanomethyl)phenyl]-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-[4-(cyanomethyl)phenyl]-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
N-[4-(cyanomethyl)phenyl]-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | 8016-8476 |
| Compound Name: | N-[4-(cyanomethyl)phenyl]-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 394.21 |
| Molecular Formula: | C15 H15 I N4 O |
| Smiles: | Cc1c(c(C)n(CC(Nc2ccc(CC#N)cc2)=O)n1)I |
| Stereo: | ACHIRAL |
| logP: | 1.6626 |
| logD: | 1.6626 |
| logSw: | -2.2311 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.161 |
| InChI Key: | NVUSXGDYALLFDJ-UHFFFAOYSA-N |