2-{[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(3-methylphenyl)acetamide
2-{[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(3-methylphenyl)acetamide
Compound characteristics
Compound ID: | G432-0066 |
Compound Name: | 2-{[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(3-methylphenyl)acetamide |
Molecular Weight: | 374.48 |
Molecular Formula: | C17 H18 N4 O2 S2 |
Smiles: | CCC1=NN2C(=NC(CSCC(Nc3cccc(C)c3)=O)=CC2=O)S1 |
Stereo: | ACHIRAL |
logP: | 3.3028 |
logD: | 3.2997 |
logSw: | -3.4587 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.324 |
InChI Key: | UUBDEPQRJARVLK-UHFFFAOYSA-N |