TL;DR: 3,3'-[Benzene-1,3-diylbis(oxy)]bis[1-(piperidin-1-yl)propan-2-ol] (CAS 100434-29-5) is a chemical compound with molecular formula C22H36N2O4 and molecular weight 392.26752 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[3-(2-hydroxy-3-piperidin-1-ylpropoxy)phenoxy]-3-piperidin-1-ylpropan-2-ol
Also Known As: med.21724, Compound 26, VE607, BAS 01814046, BIM-0044500.P001, 3,3'-[benzene-1,3-diylbis(oxy)]bis[1-(piperidin-1-yl)propan-2-ol]
| Molecular Formula | C22H36N2O4 |
| Molecular Weight | 392.26752 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 65.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 392.26752 Da |
| Heavy Atoms | 28 |
| Complexity | 377.0 |
| SMILES | C1CCN(CC1)CC(COC2=CC(=CC=C2)OCC(CN3CCCCC3)O)O |
| InChIKey | FHFSLXLDKXBOQN-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3'-[Benzene-1,3-diylbis(oxy)]bis[1-(piperidin-1-yl)propan-2-ol]. The TPSA of 65.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-[Benzene-1,3-diylbis(oxy)]bis[1-(piperidin-1-yl)propan-2-ol]. Following Lipinski's Rule of Five, 3,3'-[Benzene-1,3-diylbis(oxy)]bis[1-(piperidin-1-yl)propan-2-ol] has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3,3'-[Benzene-1,3-diylbis(oxy)]bis[1-(piperidin-1-yl)propan-2-ol] is 100434-29-5.
The molecular formula of 3,3'-[Benzene-1,3-diylbis(oxy)]bis[1-(piperidin-1-yl)propan-2-ol] is C22H36N2O4.
The molecular weight of 3,3'-[Benzene-1,3-diylbis(oxy)]bis[1-(piperidin-1-yl)propan-2-ol] is 392.26752 g/mol.
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