N-methyl-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
N-methyl-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
N-methyl-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | C210-0135 |
| Compound Name: | N-methyl-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 607.63 |
| Molecular Formula: | C25 H24 F3 N7 O4 S2 |
| Smiles: | Cc1c(c2C(N(CC(N(C)c3cccc(c3)C(F)(F)F)=O)C=Nc2s1)=O)S(N1CCN(CC1)c1ncccn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4722 |
| logD: | 2.4722 |
| logSw: | -2.8561 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 94.688 |
| InChI Key: | GTCHBXBSSSZGEO-UHFFFAOYSA-N |