N-(5-{[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(2-methylphenoxy)acetamide
Chemical Structure Depiction of
N-(5-{[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(2-methylphenoxy)acetamide
N-(5-{[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(2-methylphenoxy)acetamide
Compound characteristics
| Compound ID: | G072-1959 |
| Compound Name: | N-(5-{[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(2-methylphenoxy)acetamide |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C19 H18 N6 O3 S3 |
| Smiles: | CCC1=NN2C(=NC(CSc3nnc(NC(COc4ccccc4C)=O)s3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.0778 |
| logD: | 4.073 |
| logSw: | -4.2678 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.544 |
| InChI Key: | AQDMNVXQWVQZMH-UHFFFAOYSA-N |