1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine
TL;DR: 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine (CAS 825601-34-1) is a chemical compound with molecular formula C17H16ClN3 and molecular weight 297.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-chlorophenyl)methyl]-1-prop-2-enylbenzimidazol-2-amine
Also Known As: 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine, AE-848/42278605, N-[(4-chlorophenyl)methyl]-1-prop-2-enylbenzimidazol-2-amine, N-[(4-CHLOROPHENYL)METHYL]-1-(PROP-2-EN-1-YL)-1H-1,3-BENZODIAZOL-2-AMINE
| Molecular Formula | C17H16ClN3 |
|---|---|
| Molecular Weight | 297.10 g/mol |
| LogP | 4.4878 |
| Topological Polar Surface Area | 29.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.10327 |
| Heavy Atoms | 21 |
| Complexity | 759.3062 |
Chemical Identifiers
| CAS Number | 825601-34-1 |
|---|---|
| SMILES | C=CCN1C2=CC=CC=C2N=C1NCC3=CC=C(C=C3)Cl |
Product Overview
1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine (CAS 825601-34-1), with molecular formula C17H16ClN3 and molecular weight 297.10 g/mol. IUPAC: N-[(4-chlorophenyl)methyl]-1-prop-2-enylbenzimidazol-2-amine.
Chemical Property Profile of 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine
Property Insights of 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine
The XLogP value of 4.4878 indicates that 1-allyl-N-(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 29.85 Ų, 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine 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-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine?
The CAS number of 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine is 825601-34-1.
What is the molecular formula of 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine?
The molecular formula of 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine is C17H16ClN3.
What is the molecular weight of 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine?
The molecular weight of 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine is 297.10 g/mol.
Where can I buy 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine?
You can request a quote for 1-allyl-N-(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 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-allyl-N-(4-chlorobenzyl)-1H-benzimidazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.