TL;DR: 1H-Benzimidazole, 2-(4-morpholinyl)-1-(3-thietanyl)-, monohydrochloride (CAS 182193-13-1) is a chemical compound with molecular formula C14H18ClN3OS and molecular weight 311.0859 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[1-(thietan-3-yl)benzimidazol-2-yl]morpholine;hydrochloride
Also Known As: 2-Morpholino-1-(thietan-3-yl)benzimidazole hydrochloride, 1H-Benzimidazole, 2-(4-morpholinyl)-1-(3-thietanyl)-, monohydrochloride, 2-(4-Morpholinyl)-1-(3-thietanyl)-1H-benzimidazole monohydrochloride, 2-(4-Morpholinyl)-1-(3-thietanyl)-1H-benzimidazole hydrochloride, 4-[1-(thietan-3-yl)benzimidazol-2-yl]morpholine hydrochloride
| Molecular Formula | C14H18ClN3OS |
| Molecular Weight | 311.0859 g/mol |
| XLogP | 2.5826 |
| Topological Polar Surface Area (TPSA) | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 311.0859 Da |
| Heavy Atoms | 20 |
| Complexity | 320.0 |
| SMILES | C1COCCN1C2=NC3=CC=CC=C3N2C4CSC4.Cl |
| InChIKey | ORHDIUNVFSZWFW-UHFFFAOYSA-N |
The XLogP value of 2.5826 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzimidazole, 2-(4-morpholinyl)-1-(3-thietanyl)-, monohydrochloride. With a topological polar surface area (TPSA) of 55.6 Ų, 1H-Benzimidazole, 2-(4-morpholinyl)-1-(3-thietanyl)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Benzimidazole, 2-(4-morpholinyl)-1-(3-thietanyl)-, monohydrochloride has 1 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 1H-Benzimidazole, 2-(4-morpholinyl)-1-(3-thietanyl)-, monohydrochloride is 182193-13-1.
The molecular formula of 1H-Benzimidazole, 2-(4-morpholinyl)-1-(3-thietanyl)-, monohydrochloride is C14H18ClN3OS.
The molecular weight of 1H-Benzimidazole, 2-(4-morpholinyl)-1-(3-thietanyl)-, monohydrochloride is 311.0859 g/mol.
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