2-(2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamido)benzamide
Chemical Structure Depiction of
2-(2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamido)benzamide
2-(2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamido)benzamide
Compound characteristics
| Compound ID: | F813-4489 |
| Compound Name: | 2-(2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamido)benzamide |
| Molecular Weight: | 476.58 |
| Molecular Formula: | C23 H20 N6 O2 S2 |
| Smiles: | C1CN(Cc2ccccc12)c1nc2c(c(ncn2)SCC(Nc2ccccc2C(N)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.5037 |
| logD: | 3.5036 |
| logSw: | -3.786 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.395 |
| InChI Key: | ABXSJFFVAYBPFT-UHFFFAOYSA-N |