2-(2,3-dimethylphenoxy)-N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
2-(2,3-dimethylphenoxy)-N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
2-(2,3-dimethylphenoxy)-N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
Compound ID: | G566-0403 |
Compound Name: | 2-(2,3-dimethylphenoxy)-N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide |
Molecular Weight: | 457.53 |
Molecular Formula: | C20 H19 N5 O4 S2 |
Smiles: | CC1=CC2=NC(CSc3nnc(NC(COc4cccc(C)c4C)=O)s3)=CC(N2O1)=O |
Stereo: | ACHIRAL |
logP: | 3.3722 |
logD: | 3.3705 |
logSw: | -3.5639 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 91.8 |
InChI Key: | NCLYFWCGFBQYJD-UHFFFAOYSA-N |