N-(2-chloro-4-methylphenyl)-2-{3-[(furan-2-yl)methyl]-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-{3-[(furan-2-yl)methyl]-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}acetamide
N-(2-chloro-4-methylphenyl)-2-{3-[(furan-2-yl)methyl]-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}acetamide
Compound characteristics
| Compound ID: | C688-1426 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-{3-[(furan-2-yl)methyl]-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}acetamide |
| Molecular Weight: | 479.94 |
| Molecular Formula: | C24 H18 Cl N3 O4 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(CN1C(N(Cc2ccco2)C(c2c1c1ccccc1s2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1819 |
| logD: | 5.1818 |
| logSw: | -5.6388 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.371 |
| InChI Key: | BDXLOPZWYCTKHX-UHFFFAOYSA-N |