2-[5-amino-4-(methanesulfonyl)-3-(methylsulfanyl)-1H-pyrazol-1-yl]-N-(2H-1,3-benzodioxol-5-yl)acetamide
Chemical Structure Depiction of
2-[5-amino-4-(methanesulfonyl)-3-(methylsulfanyl)-1H-pyrazol-1-yl]-N-(2H-1,3-benzodioxol-5-yl)acetamide
2-[5-amino-4-(methanesulfonyl)-3-(methylsulfanyl)-1H-pyrazol-1-yl]-N-(2H-1,3-benzodioxol-5-yl)acetamide
Compound characteristics
Compound ID: | G196-0221 |
Compound Name: | 2-[5-amino-4-(methanesulfonyl)-3-(methylsulfanyl)-1H-pyrazol-1-yl]-N-(2H-1,3-benzodioxol-5-yl)acetamide |
Molecular Weight: | 384.43 |
Molecular Formula: | C14 H16 N4 O5 S2 |
Smiles: | CSc1c(c(N)n(CC(Nc2ccc3c(c2)OCO3)=O)n1)S(C)(=O)=O |
Stereo: | ACHIRAL |
logP: | 0.2515 |
logD: | 0.2515 |
logSw: | -2.4527 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 103.34 |
InChI Key: | OWQFPROLKBHJQA-UHFFFAOYSA-N |