3-methyl-7-{[(5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
3-methyl-7-{[(5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
3-methyl-7-{[(5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G072-0384 |
| Compound Name: | 3-methyl-7-{[(5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 321.42 |
| Molecular Formula: | C13 H15 N5 O S2 |
| Smiles: | CCCc1nnc([nH]1)SCC1=CC(N2C(C)=CSC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.525 |
| logD: | 1.1957 |
| logSw: | -1.9477 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.356 |
| InChI Key: | SEMDKJBBYXVBRM-UHFFFAOYSA-N |