TL;DR: 3-[1-(2-hydroxy-3-prop-2-ynoxy-propyl)-4-piperidyl]-1H-benzoimidazol-2-one (CAS 1022765-21-4) is a chemical compound with molecular formula C18H23N3O3 and molecular weight 329.17395 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[1-(2-hydroxy-3-prop-2-ynoxypropyl)piperidin-4-yl]-1H-benzimidazol-2-one
Also Known As: 3-[1-(2-hydroxy-3-prop-2-ynoxy-propyl)-4-piperidyl]-1H-benzoimidazol-2-one, 3-[1-(2-hydroxy-3-prop-2-ynoxypropyl)piperidin-4-yl]-1H-benzimidazol-2-one, 1,3-Dihydro-1-[1-[2-hydroxy-3-(Propargyloxy)-propyl]piperidin-4-yl]-2H-benzo[d]imidazol-2-one, 1-(1-(2-hydroxy-3-(prop-2-yn-1-yloxy)propyl)piperidin-4-yl)-1H-benzo[d]imidazol-2(3H)-one
| Molecular Formula | C18H23N3O3 |
| Molecular Weight | 329.17395 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 65.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 329.17395 Da |
| Heavy Atoms | 24 |
| Complexity | 481.0 |
| SMILES | C#CCOCC(CN1CCC(CC1)N2C3=CC=CC=C3NC2=O)O |
| InChIKey | PJIKPJLROZUKPE-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[1-(2-hydroxy-3-prop-2-ynoxy-propyl)-4-piperidyl]-1H-benzoimidazol-2-one. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[1-(2-hydroxy-3-prop-2-ynoxy-propyl)-4-piperidyl]-1H-benzoimidazol-2-one. Following Lipinski's Rule of Five, 3-[1-(2-hydroxy-3-prop-2-ynoxy-propyl)-4-piperidyl]-1H-benzoimidazol-2-one has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-[1-(2-hydroxy-3-prop-2-ynoxy-propyl)-4-piperidyl]-1H-benzoimidazol-2-one is 1022765-21-4.
The molecular formula of 3-[1-(2-hydroxy-3-prop-2-ynoxy-propyl)-4-piperidyl]-1H-benzoimidazol-2-one is C18H23N3O3.
The molecular weight of 3-[1-(2-hydroxy-3-prop-2-ynoxy-propyl)-4-piperidyl]-1H-benzoimidazol-2-one is 329.17395 g/mol.
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