({3-[(furan-2-yl)methyl]-8-nitro-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetonitrile
Chemical Structure Depiction of
({3-[(furan-2-yl)methyl]-8-nitro-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetonitrile
({3-[(furan-2-yl)methyl]-8-nitro-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetonitrile
Compound characteristics
| Compound ID: | K263-0049 |
| Compound Name: | ({3-[(furan-2-yl)methyl]-8-nitro-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetonitrile |
| Molecular Weight: | 398.42 |
| Molecular Formula: | C17 H10 N4 O4 S2 |
| Smiles: | C(c1ccco1)N1C(=Nc2c3cc(ccc3sc2C1=O)[N+]([O-])=O)SCC#N |
| Stereo: | ACHIRAL |
| logP: | 3.3423 |
| logD: | 3.3423 |
| logSw: | -3.6135 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.159 |
| InChI Key: | ZADJIHODKPHLMF-UHFFFAOYSA-N |