5-{[(3-chlorophenyl)sulfanyl]methyl}-2-methyl-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-one
Chemical Structure Depiction of
5-{[(3-chlorophenyl)sulfanyl]methyl}-2-methyl-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-one
5-{[(3-chlorophenyl)sulfanyl]methyl}-2-methyl-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-one
Compound characteristics
| Compound ID: | G808-0021 |
| Compound Name: | 5-{[(3-chlorophenyl)sulfanyl]methyl}-2-methyl-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-one |
| Molecular Weight: | 306.77 |
| Molecular Formula: | C14 H11 Cl N2 O2 S |
| Smiles: | CC1=CC2=NC(CSc3cccc(c3)[Cl])=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6452 |
| logD: | 2.6451 |
| logSw: | -3.2997 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.43 |
| InChI Key: | YZCWPIRTHJBEFG-UHFFFAOYSA-N |