N-(3,5-dimethylphenyl)-2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}acetamide
N-(3,5-dimethylphenyl)-2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G432-0378 |
| Compound Name: | N-(3,5-dimethylphenyl)-2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}acetamide |
| Molecular Weight: | 357.43 |
| Molecular Formula: | C18 H19 N3 O3 S |
| Smiles: | CC1=CC2=NC(CSCC(Nc3cc(C)cc(C)c3)=O)=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.527 |
| logD: | 2.527 |
| logSw: | -2.6307 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.58 |
| InChI Key: | QFRWMBLUDFAJIQ-UHFFFAOYSA-N |