N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}-2-[(4-chlorophenyl)sulfanyl]acetamide
Chemical Structure Depiction of
N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}-2-[(4-chlorophenyl)sulfanyl]acetamide
N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}-2-[(4-chlorophenyl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F172-0493 |
| Compound Name: | N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}-2-[(4-chlorophenyl)sulfanyl]acetamide |
| Molecular Weight: | 490.36 |
| Molecular Formula: | C22 H17 Cl2 N3 O4 S |
| Smiles: | CC1=CC2=NC(COc3cc(ccc3NC(CSc3ccc(cc3)[Cl])=O)[Cl])=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2167 |
| logD: | 4.2124 |
| logSw: | -4.5612 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.196 |
| InChI Key: | SPWJSQNVFHLETL-UHFFFAOYSA-N |