N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2-methyl-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
Chemical Structure Depiction of
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2-methyl-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2-methyl-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
Compound characteristics
| Compound ID: | F464-0420 |
| Compound Name: | N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2-methyl-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide |
| Molecular Weight: | 427.91 |
| Molecular Formula: | C21 H18 Cl N3 O3 S |
| Smiles: | CC1=Nc2c3ccccc3sc2C(N1CC(Nc1cc(C)c(cc1OC)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4828 |
| logD: | 4.4805 |
| logSw: | -4.5691 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.962 |
| InChI Key: | IBDGKGVGWYKNBN-UHFFFAOYSA-N |