N-(3-chlorophenyl)-2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}acetamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}acetamide
N-(3-chlorophenyl)-2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}acetamide
Compound characteristics
| Compound ID: | C688-1471 |
| Compound Name: | N-(3-chlorophenyl)-2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}acetamide |
| Molecular Weight: | 493.94 |
| Molecular Formula: | C25 H17 Cl F N3 O3 S |
| Smiles: | C(C(Nc1cccc(c1)[Cl])=O)N1C(N(Cc2ccc(cc2)F)C(c2c1c1ccccc1s2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9873 |
| logD: | 5.9872 |
| logSw: | -6.2465 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.32 |
| InChI Key: | MBQYPHHCQWVCDL-UHFFFAOYSA-N |