2-(4-{2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-[(furan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-(4-{2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-[(furan-2-yl)methyl]acetamide
2-(4-{2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-[(furan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C241-1875 |
| Compound Name: | 2-(4-{2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-[(furan-2-yl)methyl]acetamide |
| Molecular Weight: | 539.57 |
| Molecular Formula: | C28 H21 N5 O5 S |
| Smiles: | C(C(NCc1ccco1)=O)c1ccc(cc1)N1C(c2c(ccs2)N(CC2=CC(N3C=CC=CC3=N2)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.312 |
| logD: | 2.312 |
| logSw: | -2.7096 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.609 |
| InChI Key: | WUHCMMHOMNXUQL-UHFFFAOYSA-N |