benzyl [3-(3-{[(furan-2-yl)methyl]amino}-3-oxopropyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetate
Chemical Structure Depiction of
benzyl [3-(3-{[(furan-2-yl)methyl]amino}-3-oxopropyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetate
benzyl [3-(3-{[(furan-2-yl)methyl]amino}-3-oxopropyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetate
Compound characteristics
| Compound ID: | C241-1515 |
| Compound Name: | benzyl [3-(3-{[(furan-2-yl)methyl]amino}-3-oxopropyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetate |
| Molecular Weight: | 467.5 |
| Molecular Formula: | C23 H21 N3 O6 S |
| Smiles: | C(CN1C(c2c(ccs2)N(CC(=O)OCc2ccccc2)C1=O)=O)C(NCc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2622 |
| logD: | 3.2622 |
| logSw: | -3.3388 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.018 |
| InChI Key: | PXKPYBQMLXOGSL-UHFFFAOYSA-N |