2-[3-{4-[2-(benzylamino)-2-oxoethyl]phenyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[3-{4-[2-(benzylamino)-2-oxoethyl]phenyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-fluorophenyl)acetamide
2-[3-{4-[2-(benzylamino)-2-oxoethyl]phenyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | C241-1925 |
| Compound Name: | 2-[3-{4-[2-(benzylamino)-2-oxoethyl]phenyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 542.59 |
| Molecular Formula: | C29 H23 F N4 O4 S |
| Smiles: | C(C(NCc1ccccc1)=O)c1ccc(cc1)N1C(c2c(ccs2)N(CC(Nc2ccc(cc2)F)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7275 |
| logD: | 3.7275 |
| logSw: | -4.1998 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.023 |
| InChI Key: | DATTVGCVRJDNHM-UHFFFAOYSA-N |