2-(4-{1-[2-(3,4-dimethylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-[(furan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-(4-{1-[2-(3,4-dimethylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-[(furan-2-yl)methyl]acetamide
2-(4-{1-[2-(3,4-dimethylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-[(furan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C241-1873 |
| Compound Name: | 2-(4-{1-[2-(3,4-dimethylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-[(furan-2-yl)methyl]acetamide |
| Molecular Weight: | 542.61 |
| Molecular Formula: | C29 H26 N4 O5 S |
| Smiles: | Cc1ccc(cc1C)NC(CN1C(N(C(c2c1ccs2)=O)c1ccc(CC(NCc2ccco2)=O)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4365 |
| logD: | 4.4365 |
| logSw: | -4.3281 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.772 |
| InChI Key: | XMSNFGFBCRRZPG-UHFFFAOYSA-N |