4-{2-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl}-N-[(oxolan-2-yl)methyl]butanamide
Chemical Structure Depiction of
4-{2-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl}-N-[(oxolan-2-yl)methyl]butanamide
4-{2-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl}-N-[(oxolan-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | C604-0180 |
| Compound Name: | 4-{2-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl}-N-[(oxolan-2-yl)methyl]butanamide |
| Molecular Weight: | 540.66 |
| Molecular Formula: | C26 H28 N4 O5 S2 |
| Smiles: | C(CC(NCC1CCCO1)=O)CN1C(=Nc2c3ccccc3sc2C1=O)SCC(NCc1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3147 |
| logD: | 2.3147 |
| logSw: | -2.649 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.59 |
| InChI Key: | QLSOYKOTCWLQHN-QGZVFWFLSA-N |