RefChem:437922
TL;DR: RefChem:437922 (CAS 85371-59-1) is a chemical compound with molecular formula C19H24BF4N6- and molecular weight 423.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-4-[(2,4-dimethyl-3H-1,2,4-triazol-5-yl)diazenyl]-N-ethylaniline tetrafluoroborate
Also Known As: 1H-1,2,4-Triazolium, 3(or 5)-((4-(ethyl(phenylmethyl)amino)phenyl)azo)-1,4-dimethyl-, tetrafluoroborate(1-), 1H-1,2,4-Triazolium, 3(or 5)-(2-(4-(ethyl(phenylmethyl)amino)phenyl)diazenyl)-1,4-dimethyl-, tetrafluoroborate(1-) (1:1), 3(Or5)-((4-(benzylethylamino)phenyl)azo)-1,4-dimethyl-1H-1,2,4-triazolium tetrafluoroborate(1-), 3(or5)-[[4-[benzylethylamino]phenyl]azo]-1,4-dimethyl-1H-1,2,4-triazolium tetrafluoroborate(1-), 1H-1,2,4-Triazolium, 3(or 5)-[[4-[ethyl(phenylmethyl)amino]phenyl]azo]-1,4-dimethyl-, tetrafluoroborate(1-)
| Molecular Formula | C19H24BF4N6- |
|---|---|
| Molecular Weight | 423.21 g/mol |
| LogP | 5.2025 |
| Topological Polar Surface Area | 46.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.20917 |
| Heavy Atoms | 30 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 85371-59-1 |
|---|---|
| SMILES | [B-](F)(F)(F)F.CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NN(CN3C)C |
| InChIKey | JDNVKACOXIXYQW-UHFFFAOYSA-N |
Product Overview
RefChem:437922 (CAS 85371-59-1), with molecular formula C19H24BF4N6- and molecular weight 423.21 g/mol. IUPAC: N-benzyl-4-[(2,4-dimethyl-3H-1,2,4-triazol-5-yl)diazenyl]-N-ethylaniline tetrafluoroborate.
Chemical Property Profile of RefChem:437922
Property Insights of RefChem:437922
The XLogP value of 5.2025 indicates that RefChem:437922 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.8 Ų, RefChem:437922 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:437922 has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:437922?
The CAS number of RefChem:437922 is 85371-59-1.
What is the molecular formula of RefChem:437922?
The molecular formula of RefChem:437922 is C19H24BF4N6-.
What is the molecular weight of RefChem:437922?
The molecular weight of RefChem:437922 is 423.21 g/mol.
Where can I buy RefChem:437922?
You can request a quote for RefChem:437922 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:437922?
Yes, KEHONG BIO provides custom synthesis services for RefChem:437922 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.