1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride
TL;DR: 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride (CAS 63658-99-1) is a chemical compound with molecular formula C16H26ClN3O and molecular weight 311.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(heptoxymethyl)-3-methylbenzimidazol-2-imine;hydrochloride
Also Known As: 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride, 2H-Benzimidazol-2-imine, 1,3-dihydro-1-((heptyloxy)methyl)-3-methyl-, monohydrochloride, 1-(heptoxymethyl)-3-methylbenzimidazol-2-imine hydrochloride, 1-[(Heptyloxy)methyl]-3-methyl-1,3-dihydro-2H-1,3-benzimidazol-2-imine--hydrogen chloride (1/1), 1-[(Heptyloxy)methyl]-3-methyl-1,3-dihydro-2H-benzimidazol-2-imine--hydrogen chloride (1/1)
| Molecular Formula | C16H26ClN3O |
|---|---|
| Molecular Weight | 311.18 g/mol |
| LogP | 3.82557 |
| Topological Polar Surface Area | 42.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 311.17645 |
| Heavy Atoms | 21 |
| Complexity | 603.0782 |
Chemical Identifiers
| CAS Number | 63658-99-1 |
|---|---|
| SMILES | CCCCCCCOCN1C2=CC=CC=C2N(C1=N)C.Cl |
Product Overview
1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride (CAS 63658-99-1), with molecular formula C16H26ClN3O and molecular weight 311.18 g/mol. IUPAC: 1-(heptoxymethyl)-3-methylbenzimidazol-2-imine;hydrochloride.
Chemical Property Profile of 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride
Property Insights of 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride
The XLogP value of 3.82557 indicates that 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.94 Ų, 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride?
The CAS number of 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride is 63658-99-1.
What is the molecular formula of 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride?
The molecular formula of 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride is C16H26ClN3O.
What is the molecular weight of 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride?
The molecular weight of 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride is 311.18 g/mol.
Where can I buy 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride?
You can request a quote for 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dihydro-1-((heptyloxy)methyl)-3-methyl-2H-benzimidazol-2-imine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.