N-(2H-1,3-benzodioxol-5-yl)-2-[(3-benzyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[(3-benzyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[(3-benzyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F396-0743 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[(3-benzyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 502.57 |
| Molecular Formula: | C25 H18 N4 O4 S2 |
| Smiles: | C(c1ccccc1)N1C(=Nc2c3cccnc3sc2C1=O)SCC(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4851 |
| logD: | 4.4851 |
| logSw: | -4.5156 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.936 |
| InChI Key: | FJKPBPBLKXSSCR-UHFFFAOYSA-N |