TL;DR: 4-[(1-Methylbenzimidazol-2-yl)methyl]morpholine (CAS 100705-41-7) is a chemical compound with molecular formula C13H17N3O and molecular weight 231.13716 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(1-methylbenzimidazol-2-yl)methyl]morpholine
Also Known As: BAS 11788166, 4-[(1-methylbenzimidazol-2-yl)methyl]morpholine, 1-methyl-2-(morpholin-4-ylmethyl)-1H-benzimidazole, 1-Methyl-2-morpholin-4-ylmethyl-1H-benzoimidazole, 1-methyl-2-(morpholinomethyl)-1H-1,3-benzimidazole
| Molecular Formula | C13H17N3O |
| Molecular Weight | 231.13716 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 30.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.13716 Da |
| Heavy Atoms | 17 |
| Complexity | 255.0 |
| SMILES | CN1C2=CC=CC=C2N=C1CN3CCOCC3 |
| InChIKey | BPNBHFNVNWZKPF-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(1-Methylbenzimidazol-2-yl)methyl]morpholine. With a topological polar surface area (TPSA) of 30.3 Ų, 4-[(1-Methylbenzimidazol-2-yl)methyl]morpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(1-Methylbenzimidazol-2-yl)methyl]morpholine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-[(1-Methylbenzimidazol-2-yl)methyl]morpholine is 100705-41-7.
The molecular formula of 4-[(1-Methylbenzimidazol-2-yl)methyl]morpholine is C13H17N3O.
The molecular weight of 4-[(1-Methylbenzimidazol-2-yl)methyl]morpholine is 231.13716 g/mol.
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