2-({3-[2-(diethylamino)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(4-fluorophenyl)acetamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-({3-[2-(diethylamino)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(4-fluorophenyl)acetamide--hydrogen chloride (1/1)
2-({3-[2-(diethylamino)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(4-fluorophenyl)acetamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | K263-0303 |
| Compound Name: | 2-({3-[2-(diethylamino)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(4-fluorophenyl)acetamide--hydrogen chloride (1/1) |
| Molecular Weight: | 521.07 |
| Molecular Formula: | C24 H25 F N4 O2 S2 |
| Salt: | HCl |
| Smiles: | CCN(CC)CCN1C(=Nc2c3ccccc3sc2C1=O)SCC(Nc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6804 |
| logD: | 2.6057 |
| logSw: | -4.2787 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.076 |
| InChI Key: | ZUMNHRGDKJNTOO-UHFFFAOYSA-N |