Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride
TL;DR: Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride (CAS 102517-01-1) is a chemical compound with molecular formula C15H25Cl2N3 and molecular weight 317.14255 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1H-benzimidazol-3-ium-2-ylmethyl(heptyl)azanium dichloride
Also Known As: 2-Heptylaminomethylbenzimidazole dihydrochloride, BENZIMIDAZOLE, 2-(HEPTYLAMINOMETHYL)-, DIHYDROCHLORIDE, 1H-benzimidazol-3-ium-2-ylmethyl(heptyl)azanium dichloride, 1H-benzimidazol-1-ium-2-ylmethyl(heptyl)azanium
Technical Specifications
| Molecular Formula | C15H25Cl2N3 |
| Molecular Weight | 317.14255 g/mol |
| XLogP | -3.98 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 317.14255 Da |
| Heavy Atoms | 20 |
| Complexity | 206.0 |
| SMILES | CCCCCCC[NH2+]CC1=[NH+]C2=CC=CC=C2N1.[Cl-].[Cl-] |
| InChIKey | XPYIJYLAVYOKKS-UHFFFAOYSA-N |
Chemical Property Profile of Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride
Property Insights of Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride
The XLogP value of -3.98 indicates that Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.5 Ų, Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride?
The CAS number of Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride is 102517-01-1.
What is the molecular formula of Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride?
The molecular formula of Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride is C15H25Cl2N3.
What is the molecular weight of Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride?
The molecular weight of Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride is 317.14255 g/mol.
Where can I buy Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride?
You can request a quote for Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride?
Yes, CoreyChem provides custom synthesis services for Benzimidazole, 2-(heptylaminomethyl)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.