![4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol structure](/static/products/404/404840-96-6.png)
4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol
TL;DR: 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol (CAS 404840-96-6) is a chemical compound with molecular formula C18H20ClN3O and molecular weight 329.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-[1-[(1-propylbenzimidazol-2-yl)amino]ethyl]phenol
Also Known As: VU0060938-1, 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol, 4-chloro-2-[1-[(1-propylbenzimidazol-2-yl)amino]ethyl]phenol, 4-chloro-2-(1-((1-propyl-1H-benzo[d]imidazol-2-yl)amino)ethyl)phenol, 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-3-ium-2-yl)amino]ethyl}phenolate
| Molecular Formula | C18H20ClN3O |
|---|---|
| Molecular Weight | 329.13 g/mol |
| LogP | 4.9784 |
| Topological Polar Surface Area | 50.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.1295 |
| Heavy Atoms | 23 |
| Complexity | 828.2448 |
Chemical Identifiers
| CAS Number | 404840-96-6 |
|---|---|
| SMILES | CCCN1C2=CC=CC=C2N=C1NC(C)C3=C(C=CC(=C3)Cl)O |
Product Overview
4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol (CAS 404840-96-6), with molecular formula C18H20ClN3O and molecular weight 329.13 g/mol. IUPAC: 4-chloro-2-[1-[(1-propylbenzimidazol-2-yl)amino]ethyl]phenol.
Chemical Property Profile of 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol
Property Insights of 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol
The XLogP value of 4.9784 indicates that 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.08 Ų, 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol has 2 hydrogen bond donor(s) and 3 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-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol?
The CAS number of 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol is 404840-96-6.
What is the molecular formula of 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol?
The molecular formula of 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol is C18H20ClN3O.
What is the molecular weight of 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol?
The molecular weight of 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol is 329.13 g/mol.
Where can I buy 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol?
You can request a quote for 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-2-{1-[(1-propyl-1H-benzimidazol-2-yl)amino]ethyl}phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.