3-[3-(4-ethylpiperazin-1-yl)propyl]-2-sulfanylidene-2,3-dihydro[1]benzothieno[3,2-d]pyrimidin-4(1H)-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-[3-(4-ethylpiperazin-1-yl)propyl]-2-sulfanylidene-2,3-dihydro[1]benzothieno[3,2-d]pyrimidin-4(1H)-one--hydrogen chloride (1/1)
3-[3-(4-ethylpiperazin-1-yl)propyl]-2-sulfanylidene-2,3-dihydro[1]benzothieno[3,2-d]pyrimidin-4(1H)-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | K263-0140 |
| Compound Name: | 3-[3-(4-ethylpiperazin-1-yl)propyl]-2-sulfanylidene-2,3-dihydro[1]benzothieno[3,2-d]pyrimidin-4(1H)-one--hydrogen chloride (1/1) |
| Molecular Weight: | 425.01 |
| Molecular Formula: | C19 H24 N4 O S2 |
| Salt: | HCl |
| Smiles: | CCN1CCN(CCCN2C(c3c(c4ccccc4s3)NC2=S)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.4388 |
| logD: | 1.4906 |
| logSw: | -2.773 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.31 |
| InChI Key: | SUNVBYJMHZIXHK-UHFFFAOYSA-N |