N-{4-[(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)sulfamoyl]phenyl}acetamide
Chemical Structure Depiction of
N-{4-[(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)sulfamoyl]phenyl}acetamide
N-{4-[(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)sulfamoyl]phenyl}acetamide
Compound characteristics
| Compound ID: | G072-1686 |
| Compound Name: | N-{4-[(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)sulfamoyl]phenyl}acetamide |
| Molecular Weight: | 484.55 |
| Molecular Formula: | C22 H20 N4 O5 S2 |
| Smiles: | CC1=CC2=NC(CSc3ccccc3NS(c3ccc(cc3)NC(C)=O)(=O)=O)=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8946 |
| logD: | 1.8901 |
| logSw: | -2.6408 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.644 |
| InChI Key: | OEYKBMSWFRVIDV-UHFFFAOYSA-N |