4-tert-butyl-N-(2-{[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
4-tert-butyl-N-(2-{[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)benzamide
4-tert-butyl-N-(2-{[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)benzamide
Compound characteristics
Compound ID: | G072-1066 |
Compound Name: | 4-tert-butyl-N-(2-{[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)benzamide |
Molecular Weight: | 464.61 |
Molecular Formula: | C24 H24 N4 O2 S2 |
Smiles: | CC1=NN2C(=NC(CSc3ccccc3NC(c3ccc(cc3)C(C)(C)C)=O)=CC2=O)S1 |
Stereo: | ACHIRAL |
logP: | 5.3067 |
logD: | 5.304 |
logSw: | -5.2952 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.837 |
InChI Key: | LBXNDECTHBJTPU-UHFFFAOYSA-N |