1-([1,4'-bipiperidin]-1'-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-([1,4'-bipiperidin]-1'-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)ethan-1-one
1-([1,4'-bipiperidin]-1'-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | E008-0033 |
| Compound Name: | 1-([1,4'-bipiperidin]-1'-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)ethan-1-one |
| Molecular Weight: | 463.64 |
| Molecular Formula: | C26 H33 N5 O S |
| Smiles: | C1CCN(CC1)C1CCN(CC1)C(CSCc1cnn(c2ccccc2)c1n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5939 |
| logD: | 1.0383 |
| logSw: | -4.2088 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.309 |
| InChI Key: | LSPUANXRYQAHKE-UHFFFAOYSA-N |