7-[({4-methyl-5-[(1-methyl-1H-pyrrol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-[({4-methyl-5-[(1-methyl-1H-pyrrol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
7-[({4-methyl-5-[(1-methyl-1H-pyrrol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | Y206-7310 |
| Compound Name: | 7-[({4-methyl-5-[(1-methyl-1H-pyrrol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 372.47 |
| Molecular Formula: | C16 H16 N6 O S2 |
| Smiles: | Cn1cccc1Cc1nnc(n1C)SCC1=CC(N2C=CSC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9762 |
| logD: | 0.9761 |
| logSw: | -1.9659 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.88 |
| InChI Key: | CTKRMIJBIXOXHK-UHFFFAOYSA-N |