1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine
TL;DR: 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine (CAS 331850-27-2) is a chemical compound with molecular formula C18H21N3 and molecular weight 279.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-tert-butylphenyl)methyl]benzimidazol-2-amine
Also Known As: 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine, 1-[(4-tert-butylphenyl)methyl]benzimidazol-2-amine, AE-848/34719053, 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine #, 1-(4-Tert.-butylbenzyl)-1H-benzimidazole-2-yl-amine
| Molecular Formula | C18H21N3 |
|---|---|
| Molecular Weight | 279.17 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.17355 |
| Heavy Atoms | 21 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 331850-27-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2N |
| InChIKey | RHIXFPLWWKESHT-UHFFFAOYSA-N |
Product Overview
1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine (CAS 331850-27-2), with molecular formula C18H21N3 and molecular weight 279.17 g/mol. IUPAC: 1-[(4-tert-butylphenyl)methyl]benzimidazol-2-amine.
Chemical Property Profile of 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine
Property Insights of 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine
The XLogP value of 4.2 indicates that 1-(4-tert-Butylbenzyl)-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 43.8 Ų, 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-tert-Butylbenzyl)-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-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine?
The CAS number of 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine is 331850-27-2.
What is the molecular formula of 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine?
The molecular formula of 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine is C18H21N3.
What is the molecular weight of 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine?
The molecular weight of 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine is 279.17 g/mol.
Where can I buy 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine?
You can request a quote for 1-(4-tert-Butylbenzyl)-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-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-tert-Butylbenzyl)-1H-benzimidazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.