RefChem:117636
TL;DR: RefChem:117636 (CAS 35714-87-5) is a chemical compound with molecular formula C25H29Cl2N5O2 and molecular weight 501.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-[2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethylanilino]ethyl]-dimethylazanium chloride
Also Known As: Benzyl(2-((4-((2-chloro-4-nitrophenyl)azo)phenyl)ethylamino)ethyl)dimethylammonium chloride, 2-(N-Ethyl-N-(4-((2-chloro-4-nitrophenyl)azo)phenyl)amino)-N-phenylmethyl-N,N-dimethylethanaminium, chloride, Benzenemethanaminium, N-(2-((4-((2-chloro-4-nitrophenyl)azo)phenyl)ethylamino)ethyl)-N,N-dimethyl-, chloride, Benzenemethanaminium, N-(2-((4-(2-(2-chloro-4-nitrophenyl)diazenyl)phenyl)ethylamino)ethyl)-N,N-dimethyl-, chloride (1:1), Benzenemethanaminium, N-[2-[[4-[(2-chloro-4-nitrophenyl)azo]phenyl]ethylamino]ethyl]-N,N-dimethyl-, chloride
| Molecular Formula | C25H29Cl2N5O2 |
|---|---|
| Molecular Weight | 501.17 g/mol |
| LogP | 3.77 |
| Topological Polar Surface Area | 73.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 501.16983 |
| Heavy Atoms | 34 |
| Complexity | 627.0 |
Chemical Identifiers
| CAS Number | 35714-87-5 |
|---|---|
| SMILES | CCN(CC[N+](C)(C)CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl.[Cl-] |
| InChIKey | PXXCCMGFXWJIJS-UHFFFAOYSA-M |
Product Overview
RefChem:117636 (CAS 35714-87-5), with molecular formula C25H29Cl2N5O2 and molecular weight 501.17 g/mol. IUPAC: benzyl-[2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethylanilino]ethyl]-dimethylazanium chloride.
Chemical Property Profile of RefChem:117636
Property Insights of RefChem:117636
The XLogP value of 3.77 indicates that RefChem:117636 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:117636. Following Lipinski's Rule of Five, RefChem:117636 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:117636?
The CAS number of RefChem:117636 is 35714-87-5.
What is the molecular formula of RefChem:117636?
The molecular formula of RefChem:117636 is C25H29Cl2N5O2.
What is the molecular weight of RefChem:117636?
The molecular weight of RefChem:117636 is 501.17 g/mol.
Where can I buy RefChem:117636?
You can request a quote for RefChem:117636 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:117636?
Yes, KEHONG BIO provides custom synthesis services for RefChem:117636 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.