N-(5-chloro-2-methoxyphenyl)-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide
N-(5-chloro-2-methoxyphenyl)-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F813-4524 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide |
| Molecular Weight: | 498.02 |
| Molecular Formula: | C23 H20 Cl N5 O2 S2 |
| Smiles: | COc1ccc(cc1NC(CSc1c2c(ncn1)nc(N1CCc3ccccc3C1)s2)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1692 |
| logD: | 5.165 |
| logSw: | -5.5034 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.966 |
| InChI Key: | MXJCJYCQTXMHGU-UHFFFAOYSA-N |