2-methyl-7-{[(4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-methyl-7-{[(4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
2-methyl-7-{[(4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G072-0413 |
| Compound Name: | 2-methyl-7-{[(4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 279.34 |
| Molecular Formula: | C10 H9 N5 O S2 |
| Smiles: | CC1=CN2C(=NC(CSc3nnc[nH]3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 0.0028 |
| logD: | -0.3517 |
| logSw: | -1.7069 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.866 |
| InChI Key: | GQXLIBVGLLKOSF-UHFFFAOYSA-N |