tris(N-methylbenzimidazol-2-ylmethyl)amine
TL;DR: tris(N-methylbenzimidazol-2-ylmethyl)amine (CAS 82137-72-2) is a chemical compound with molecular formula C27H27N7 and molecular weight 449.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-methylbenzimidazol-2-yl)-N,N-bis[(1-methylbenzimidazol-2-yl)methyl]methanamine
Also Known As: tris(N-methylbenzimidazol-2-ylmethyl)amine, J1.053.253A, Tris[(N-methyl-2-benzimidazolyl)methyl]amine, tris((1-methyl-1H-benzo[d]imidazol-2-yl)methyl)amine, Tris(1-methyl-1H-benzimidazole-2-ylmethyl)amine
| Molecular Formula | C27H27N7 |
|---|---|
| Molecular Weight | 449.23 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 56.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 449.2328 |
| Heavy Atoms | 34 |
| Complexity | 600.0 |
Chemical Identifiers
| CAS Number | 82137-72-2 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1CN(CC3=NC4=CC=CC=C4N3C)CC5=NC6=CC=CC=C6N5C |
| InChIKey | PVERJKNCKZHUDS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
tris(N-methylbenzimidazol-2-ylmethyl)amine (CAS 82137-72-2), with molecular formula C27H27N7 and molecular weight 449.23 g/mol. IUPAC: 1-(1-methylbenzimidazol-2-yl)-N,N-bis[(1-methylbenzimidazol-2-yl)methyl]methanamine.
Chemical Property Profile of tris(N-methylbenzimidazol-2-ylmethyl)amine
Property Insights of tris(N-methylbenzimidazol-2-ylmethyl)amine
The XLogP value of 3.4 indicates that tris(N-methylbenzimidazol-2-ylmethyl)amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.7 Ų, tris(N-methylbenzimidazol-2-ylmethyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tris(N-methylbenzimidazol-2-ylmethyl)amine has 0 hydrogen bond donor(s) and 4 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 tris(N-methylbenzimidazol-2-ylmethyl)amine?
The CAS number of tris(N-methylbenzimidazol-2-ylmethyl)amine is 82137-72-2.
What is the molecular formula of tris(N-methylbenzimidazol-2-ylmethyl)amine?
The molecular formula of tris(N-methylbenzimidazol-2-ylmethyl)amine is C27H27N7.
What is the molecular weight of tris(N-methylbenzimidazol-2-ylmethyl)amine?
The molecular weight of tris(N-methylbenzimidazol-2-ylmethyl)amine is 449.23 g/mol.
Where can I buy tris(N-methylbenzimidazol-2-ylmethyl)amine?
You can request a quote for tris(N-methylbenzimidazol-2-ylmethyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tris(N-methylbenzimidazol-2-ylmethyl)amine?
Yes, KEHONG BIO provides custom synthesis services for tris(N-methylbenzimidazol-2-ylmethyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.