5-{[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-2-methyl-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-one
Chemical Structure Depiction of
5-{[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-2-methyl-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-one
5-{[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-2-methyl-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-one
Compound characteristics
| Compound ID: | G072-1030 |
| Compound Name: | 5-{[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-2-methyl-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-one |
| Molecular Weight: | 278.29 |
| Molecular Formula: | C10 H10 N6 O2 S |
| Smiles: | CC1=CC2=NC(CSc3nnc(N)[nH]3)=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | -1.01 |
| logD: | -1.1381 |
| logSw: | -1.3255 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.675 |
| InChI Key: | AUGUZHYZNFIKPZ-UHFFFAOYSA-N |