2-(4-chlorophenoxy)-N-{3-[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}acetamide
Chemical Structure Depiction of
2-(4-chlorophenoxy)-N-{3-[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}acetamide
2-(4-chlorophenoxy)-N-{3-[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}acetamide
Compound characteristics
| Compound ID: | C679-4026 |
| Compound Name: | 2-(4-chlorophenoxy)-N-{3-[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}acetamide |
| Molecular Weight: | 456.91 |
| Molecular Formula: | C21 H17 Cl N4 O4 S |
| Smiles: | CC1=NN2C(=NC(COc3cccc(c3)NC(COc3ccc(cc3)[Cl])=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.8133 |
| logD: | 3.8082 |
| logSw: | -4.3221 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.32 |
| InChI Key: | ZXBCUYMCUMBWCU-UHFFFAOYSA-N |