(5-hydroxy-4-{[4-(propane-2-sulfonyl)piperazin-1-yl]methyl}-1-benzofuran-3-yl)[4-(methylsulfanyl)phenyl]methanone
Chemical Structure Depiction of
(5-hydroxy-4-{[4-(propane-2-sulfonyl)piperazin-1-yl]methyl}-1-benzofuran-3-yl)[4-(methylsulfanyl)phenyl]methanone
(5-hydroxy-4-{[4-(propane-2-sulfonyl)piperazin-1-yl]methyl}-1-benzofuran-3-yl)[4-(methylsulfanyl)phenyl]methanone
Compound characteristics
| Compound ID: | Y043-5340 |
| Compound Name: | (5-hydroxy-4-{[4-(propane-2-sulfonyl)piperazin-1-yl]methyl}-1-benzofuran-3-yl)[4-(methylsulfanyl)phenyl]methanone |
| Molecular Weight: | 488.62 |
| Molecular Formula: | C24 H28 N2 O5 S2 |
| Smiles: | CC(C)S(N1CCN(CC1)Cc1c(ccc2c1c(co2)C(c1ccc(cc1)SC)=O)O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9109 |
| logD: | 3.9035 |
| logSw: | -3.8548 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.336 |
| InChI Key: | KWMUGJLAKOESKC-UHFFFAOYSA-N |