N-(butan-2-yl)-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(butan-2-yl)-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide
N-(butan-2-yl)-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F813-4550 |
| Compound Name: | N-(butan-2-yl)-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide |
| Molecular Weight: | 413.56 |
| Molecular Formula: | C20 H23 N5 O S2 |
| Smiles: | CCC(C)NC(CSc1c2c(ncn1)nc(N1CCc3ccccc3C1)s2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0635 |
| logD: | 4.0635 |
| logSw: | -3.8831 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.069 |
| InChI Key: | NXBAWFTXWGVKLF-ZDUSSCGKSA-N |