2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide
Chemical Structure Depiction of
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide
Compound characteristics
Compound ID: | G328-0524 |
Compound Name: | 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide |
Molecular Weight: | 303.42 |
Molecular Formula: | C16 H21 N3 O S |
Smiles: | Cc1c(CC(NCCc2ccc(cc2)SC)=O)c(C)[nH]n1 |
Stereo: | ACHIRAL |
logP: | 2.2754 |
logD: | 2.2752 |
logSw: | -2.7734 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 48.195 |
InChI Key: | DONJJMFIFORQEG-UHFFFAOYSA-N |