2-{2,4-dioxo-3-[3-(trifluoromethyl)phenyl]-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl}-N-[(4-methylphenyl)methyl]butanamide
Chemical Structure Depiction of
2-{2,4-dioxo-3-[3-(trifluoromethyl)phenyl]-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl}-N-[(4-methylphenyl)methyl]butanamide
2-{2,4-dioxo-3-[3-(trifluoromethyl)phenyl]-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl}-N-[(4-methylphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | C200-0894 |
| Compound Name: | 2-{2,4-dioxo-3-[3-(trifluoromethyl)phenyl]-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl}-N-[(4-methylphenyl)methyl]butanamide |
| Molecular Weight: | 501.53 |
| Molecular Formula: | C25 H22 F3 N3 O3 S |
| Smiles: | CCC(C(NCc1ccc(C)cc1)=O)N1C(N(C(c2c1ccs2)=O)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8093 |
| logD: | 4.8093 |
| logSw: | -4.6407 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.284 |
| InChI Key: | TXVKAKYGEWPJDQ-IBGZPJMESA-N |