2-[7-acetyl-3-(3-acetylphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]-N-(3-fluoro-4-methylphenyl)acetamide
Chemical Structure Depiction of
2-[7-acetyl-3-(3-acetylphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]-N-(3-fluoro-4-methylphenyl)acetamide
2-[7-acetyl-3-(3-acetylphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]-N-(3-fluoro-4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | C728-0434 |
| Compound Name: | 2-[7-acetyl-3-(3-acetylphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]-N-(3-fluoro-4-methylphenyl)acetamide |
| Molecular Weight: | 548.59 |
| Molecular Formula: | C28 H25 F N4 O5 S |
| Smiles: | CC(c1cccc(c1)N1C(c2c3CCN(Cc3sc2N(CC(Nc2ccc(C)c(c2)F)=O)C1=O)C(C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1514 |
| logD: | 3.1513 |
| logSw: | -3.3124 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.133 |
| InChI Key: | BHPPTMUGOLMMGS-UHFFFAOYSA-N |