2-[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-(5-methyl-1H-pyrazol-3-yl)acetamide
Chemical Structure Depiction of
2-[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-(5-methyl-1H-pyrazol-3-yl)acetamide
2-[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-(5-methyl-1H-pyrazol-3-yl)acetamide
Compound characteristics
| Compound ID: | C258-0270 |
| Compound Name: | 2-[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-(5-methyl-1H-pyrazol-3-yl)acetamide |
| Molecular Weight: | 495.56 |
| Molecular Formula: | C24 H25 N5 O5 S |
| Smiles: | Cc1cc(NC(CN2C(N(C(c3c4CCCCc4sc23)=O)c2ccc(cc2OC)OC)=O)=O)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.638 |
| logD: | 3.6361 |
| logSw: | -4.4037 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.185 |
| InChI Key: | IMPVBQHLJIICBO-UHFFFAOYSA-N |