2-{6-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-5-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-{6-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-5-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
2-{6-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-5-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | K892-0223 |
| Compound Name: | 2-{6-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-5-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 585.6 |
| Molecular Formula: | C28 H26 F3 N5 O4 S |
| Smiles: | Cc1c2C(N(CC(Nc3cccc(c3)C(F)(F)F)=O)C=Nc2sc1C(N1CCN(CC1)c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3691 |
| logD: | 4.3688 |
| logSw: | -4.4067 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.843 |
| InChI Key: | KMXUINZUOWDGKU-UHFFFAOYSA-N |