![4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate structure](/static/products/5660/5660-35-5.webp)
4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate
TL;DR: 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate (CAS 5660-35-5) is a chemical compound with molecular formula C20H25N3O and molecular weight 323.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate
Also Known As: 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate, 4-methyl-2-[[(3-pentyl-1H-benzoimidazol-2-yl)amino]methyl]phenolate, 4-methyl-2-{[(1-pentyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}phenolate, 4-Methyl-2-{[(3-pentyl-1H-1,3-benzimidazol-3-ium-2-yl)amino]methyl}phenolate
| Molecular Formula | C20H25N3O |
|---|---|
| Molecular Weight | 323.20 g/mol |
| LogP | 3.63972 |
| Topological Polar Surface Area | 54.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 323.19977 |
| Heavy Atoms | 24 |
| Complexity | 822.86206 |
Chemical Identifiers
| CAS Number | 5660-35-5 |
|---|---|
| SMILES | CCCCC[N+]1=C(NC2=CC=CC=C21)NCC3=C(C=CC(=C3)C)[O-] |
Product Overview
4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate (CAS 5660-35-5), with molecular formula C20H25N3O and molecular weight 323.20 g/mol. IUPAC: 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate.
Chemical Property Profile of 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate
Property Insights of 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate
The XLogP value of 3.63972 indicates that 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.76 Ų, 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate has 2 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 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate?
The CAS number of 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate is 5660-35-5.
What is the molecular formula of 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate?
The molecular formula of 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate is C20H25N3O.
What is the molecular weight of 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate?
The molecular weight of 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate is 323.20 g/mol.
Where can I buy 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate?
You can request a quote for 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-2-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.