1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}ethan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | F813-4575 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 473.62 |
| Molecular Formula: | C25 H23 N5 O S2 |
| Smiles: | C1CN(Cc2ccccc12)C(CSc1c2c(ncn1)nc(N1CCc3ccccc3C1)s2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1367 |
| logD: | 5.1367 |
| logSw: | -5.2918 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.938 |
| InChI Key: | SMAPLNFRPKDDIM-UHFFFAOYSA-N |