2-{2,4-dioxo-3-[(pyridin-2-yl)methyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}-N-(3-ethylphenyl)acetamide
Chemical Structure Depiction of
2-{2,4-dioxo-3-[(pyridin-2-yl)methyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}-N-(3-ethylphenyl)acetamide
2-{2,4-dioxo-3-[(pyridin-2-yl)methyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}-N-(3-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | C688-0050 |
| Compound Name: | 2-{2,4-dioxo-3-[(pyridin-2-yl)methyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}-N-(3-ethylphenyl)acetamide |
| Molecular Weight: | 470.55 |
| Molecular Formula: | C26 H22 N4 O3 S |
| Smiles: | CCc1cccc(c1)NC(CN1C(N(Cc2ccccn2)C(c2c1c1ccccc1s2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7089 |
| logD: | 4.7089 |
| logSw: | -4.6213 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.863 |
| InChI Key: | GDQMHFWXTCKWLD-UHFFFAOYSA-N |