2-[7-acetyl-2,4-dioxo-3-(2-phenylethyl)-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]-N-(3-methyl-1H-pyrazol-5-yl)acetamide
Chemical Structure Depiction of
2-[7-acetyl-2,4-dioxo-3-(2-phenylethyl)-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]-N-(3-methyl-1H-pyrazol-5-yl)acetamide
2-[7-acetyl-2,4-dioxo-3-(2-phenylethyl)-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]-N-(3-methyl-1H-pyrazol-5-yl)acetamide
Compound characteristics
| Compound ID: | C728-0275 |
| Compound Name: | 2-[7-acetyl-2,4-dioxo-3-(2-phenylethyl)-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]-N-(3-methyl-1H-pyrazol-5-yl)acetamide |
| Molecular Weight: | 506.58 |
| Molecular Formula: | C25 H26 N6 O4 S |
| Smiles: | CC(N1CCc2c3C(N(CCc4ccccc4)C(N(CC(Nc4cc(C)n[nH]4)=O)c3sc2C1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2705 |
| logD: | 2.2701 |
| logSw: | -2.9217 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.031 |
| InChI Key: | QIMMWCMOLZUESU-UHFFFAOYSA-N |