2-(9-chloro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)-N-(2,5-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-(9-chloro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)-N-(2,5-dimethoxyphenyl)acetamide
2-(9-chloro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)-N-(2,5-dimethoxyphenyl)acetamide
Compound characteristics
Compound ID: | F464-0332 |
Compound Name: | 2-(9-chloro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)-N-(2,5-dimethoxyphenyl)acetamide |
Molecular Weight: | 429.88 |
Molecular Formula: | C20 H16 Cl N3 O4 S |
Smiles: | COc1ccc(c(c1)NC(CN1C=Nc2c3c(cccc3sc2C1=O)[Cl])=O)OC |
Stereo: | ACHIRAL |
logP: | 3.4803 |
logD: | 3.48 |
logSw: | -3.8601 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.459 |
InChI Key: | SZJXRLPUCQSRHA-UHFFFAOYSA-N |