2-{3-[3-(methylsulfanyl)phenyl]-2,4-dioxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl}-N-(propan-2-yl)acetamide
Chemical Structure Depiction of
2-{3-[3-(methylsulfanyl)phenyl]-2,4-dioxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl}-N-(propan-2-yl)acetamide
2-{3-[3-(methylsulfanyl)phenyl]-2,4-dioxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl}-N-(propan-2-yl)acetamide
Compound characteristics
| Compound ID: | F795-0016 |
| Compound Name: | 2-{3-[3-(methylsulfanyl)phenyl]-2,4-dioxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl}-N-(propan-2-yl)acetamide |
| Molecular Weight: | 440.54 |
| Molecular Formula: | C21 H20 N4 O3 S2 |
| Smiles: | CC(C)NC(CN1C(N(C(c2c1c1cccnc1s2)=O)c1cccc(c1)SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7074 |
| logD: | 2.7074 |
| logSw: | -3.2737 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.682 |
| InChI Key: | SGYWBACBHNFKJN-UHFFFAOYSA-N |