2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-N-(5-fluoro-2-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-N-(5-fluoro-2-methylphenyl)acetamide
2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-N-(5-fluoro-2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | F813-4514 |
| Compound Name: | 2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-N-(5-fluoro-2-methylphenyl)acetamide |
| Molecular Weight: | 465.57 |
| Molecular Formula: | C23 H20 F N5 O S2 |
| Smiles: | Cc1ccc(cc1NC(CSc1c2c(ncn1)nc(N1CCc3ccccc3C1)s2)=O)F |
| Stereo: | ACHIRAL |
| logP: | 4.8386 |
| logD: | 4.8384 |
| logSw: | -4.5323 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.336 |
| InChI Key: | WBQBNHBDXVJTKA-UHFFFAOYSA-N |