7-{[(4,5-dimethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-2-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[(4,5-dimethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-2-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
7-{[(4,5-dimethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-2-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G564-0363 |
| Compound Name: | 7-{[(4,5-dimethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-2-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 307.39 |
| Molecular Formula: | C12 H13 N5 O S2 |
| Smiles: | CC1=CN2C(=NC(CSc3nnc(C)n3C)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 0.4422 |
| logD: | 0.4422 |
| logSw: | -1.1026 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.574 |
| InChI Key: | QRXQDMSKRSNUIY-UHFFFAOYSA-N |