RefChem:177633
TL;DR: RefChem:177633 (CAS 6630-69-9) is a chemical compound with molecular formula C23H24ClN5O4 and molecular weight 469.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethyl-N-(2-pyridin-1-ium-1-ylethyl)aniline acetate
Also Known As: 1-[2-[[4-[(2-Chloro-4-nitrophenyl)azo]phenyl]ethylamino]ethyl]pyridinium acetate, Pyridinium, 1-(2-((4-((4-nitro-2-chlorophenyl)azo)phenyl)ethylamino)ethyl)-, acetate, 1-[2-[[4-[ azo]phenyl]ethylamino]ethyl]pyridiniumacetate, Pyridinium, 1-(2-((4-(2-(2-chloro-4-nitrophenyl)diazenyl)phenyl)ethylamino)ethyl)-, acetate (1:1), 1-{2-[{4-[(e)-(2-chloro-4-nitrophenyl)diazenyl]phenyl}(ethyl)amino]ethyl}pyridinium acetate
| Molecular Formula | C23H24ClN5O4 |
|---|---|
| Molecular Weight | 469.15 g/mol |
| LogP | 4.2338 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 469.15167 |
| Heavy Atoms | 33 |
| Complexity | 555.0 |
Chemical Identifiers
| CAS Number | 6630-69-9 |
|---|---|
| SMILES | CCN(CC[N+]1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl.CC(=O)[O-] |
| InChIKey | WQIDMVKHMHGZPN-UHFFFAOYSA-M |
Product Overview
RefChem:177633 (CAS 6630-69-9), with molecular formula C23H24ClN5O4 and molecular weight 469.15 g/mol. IUPAC: 4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethyl-N-(2-pyridin-1-ium-1-ylethyl)aniline acetate.
Chemical Property Profile of RefChem:177633
Property Insights of RefChem:177633
The XLogP value of 4.2338 indicates that RefChem:177633 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:177633. Following Lipinski's Rule of Five, RefChem:177633 has 0 hydrogen bond donor(s) and 7 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 RefChem:177633?
The CAS number of RefChem:177633 is 6630-69-9.
What is the molecular formula of RefChem:177633?
The molecular formula of RefChem:177633 is C23H24ClN5O4.
What is the molecular weight of RefChem:177633?
The molecular weight of RefChem:177633 is 469.15 g/mol.
Where can I buy RefChem:177633?
You can request a quote for RefChem:177633 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:177633?
Yes, KEHONG BIO provides custom synthesis services for RefChem:177633 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.