4-{2-[(3-benzyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamido}benzamide
Chemical Structure Depiction of
4-{2-[(3-benzyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamido}benzamide
4-{2-[(3-benzyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamido}benzamide
Compound characteristics
| Compound ID: | E580-0086 |
| Compound Name: | 4-{2-[(3-benzyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamido}benzamide |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C22 H20 N4 O3 S2 |
| Smiles: | C1CSC2=C1N=C(N(Cc1ccccc1)C2=O)SCC(Nc1ccc(cc1)C(N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1601 |
| logD: | 2.1599 |
| logSw: | -2.7364 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 83.316 |
| InChI Key: | YXLFJVMPGFPVQI-UHFFFAOYSA-N |