4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)-N-[2-(methylsulfanyl)phenyl]butanamide
Chemical Structure Depiction of
4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)-N-[2-(methylsulfanyl)phenyl]butanamide
4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)-N-[2-(methylsulfanyl)phenyl]butanamide
Compound characteristics
| Compound ID: | 8018-4516 |
| Compound Name: | 4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)-N-[2-(methylsulfanyl)phenyl]butanamide |
| Molecular Weight: | 429.32 |
| Molecular Formula: | C16 H20 I N3 O S |
| Smiles: | Cc1c(c(C)n(CCCC(Nc2ccccc2SC)=O)n1)I |
| Stereo: | ACHIRAL |
| logP: | 2.0162 |
| logD: | 2.0162 |
| logSw: | -2.5418 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.95 |
| InChI Key: | BHTUHXWKZYZTOK-UHFFFAOYSA-N |