4-[(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]-N-[3-(trifluoromethyl)phenyl]benzamide
Chemical Structure Depiction of
4-[(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]-N-[3-(trifluoromethyl)phenyl]benzamide
4-[(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]-N-[3-(trifluoromethyl)phenyl]benzamide
Compound characteristics
| Compound ID: | C203-0059 |
| Compound Name: | 4-[(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]-N-[3-(trifluoromethyl)phenyl]benzamide |
| Molecular Weight: | 445.42 |
| Molecular Formula: | C21 H14 F3 N3 O3 S |
| Smiles: | C(c1ccc(cc1)C(Nc1cccc(c1)C(F)(F)F)=O)N1C(c2c(ccs2)NC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6002 |
| logD: | 4.5792 |
| logSw: | -4.4976 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.59 |
| InChI Key: | XPVODBIWOLJBMF-UHFFFAOYSA-N |