N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine (CAS 144836-41-9) is a chemical compound with molecular formula C22H18ClN3O2 and molecular weight 391.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-chlorophenyl)methyl]benzimidazol-2-amine
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine, N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-chlorophenyl)methyl]benzimidazol-2-amine, N-(benzo[d][1,3]dioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzo[d]imidazol-2-amine, N-[(1,3-Benzodioxol-5-yl)methyl]-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine, N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[(4-chlorophenyl)methyl]-1H-1,3-benzodiazol-2-amine
| Molecular Formula | C22H18ClN3O2 |
|---|---|
| Molecular Weight | 391.11 g/mol |
| LogP | 5.0788 |
| Topological Polar Surface Area | 48.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.10876 |
| Heavy Atoms | 28 |
| Complexity | 1138.4482 |
Chemical Identifiers
| CAS Number | 144836-41-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC3=NC4=CC=CC=C4N3CC5=CC=C(C=C5)Cl |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine (CAS 144836-41-9), with molecular formula C22H18ClN3O2 and molecular weight 391.11 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-chlorophenyl)methyl]benzimidazol-2-amine.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine
The XLogP value of 5.0788 indicates that N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.31 Ų, N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine is 144836-41-9.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine is C22H18ClN3O2.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine is 391.11 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzyl)-1H-benzimidazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.