2-(4-chlorophenoxy)-N-(2-{[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)acetamide
Chemical Structure Depiction of
2-(4-chlorophenoxy)-N-(2-{[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)acetamide
2-(4-chlorophenoxy)-N-(2-{[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)acetamide
Compound characteristics
| Compound ID: | G072-1250 |
| Compound Name: | 2-(4-chlorophenoxy)-N-(2-{[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)acetamide |
| Molecular Weight: | 499.01 |
| Molecular Formula: | C23 H19 Cl N4 O3 S2 |
| Smiles: | C1CC1C1=NN2C(=NC(CSc3ccccc3NC(COc3ccc(cc3)[Cl])=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.5636 |
| logD: | 4.5602 |
| logSw: | -4.8325 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.201 |
| InChI Key: | ZMRKMBJUOQKOSP-UHFFFAOYSA-N |