Basic Yellow 51
TL;DR: Basic Yellow 51 (CAS 83949-85-3) is a chemical compound with molecular formula C22H27N3O2 and molecular weight 365.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,4-dimethyl-N-[(E)-(1,3,3-trimethylindol-1-ium-2-yl)methylideneamino]aniline acetate
Also Known As: Basic Yellow 51, EINECS 281-431-3, 1,3,3-Trimethyl-2-((methyl(p-tolyl)hydrazono)methyl)-3H-indolium acetate, 3H-Indolium, 1,3,3-trimethyl-2-((methyl(4-methylphenyl)hydrazono)methyl)-, acetate, 3H-Indolium, 1,3,3-trimethyl-2-((2-methyl-2-(4-methylphenyl)hydrazinylidene)methyl)-, acetate (1:1)
| Molecular Formula | C22H27N3O2 |
|---|---|
| Molecular Weight | 365.21 g/mol |
| LogP | 2.87942 |
| Topological Polar Surface Area | 58.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 365.21033 |
| Heavy Atoms | 27 |
| Complexity | 876.68585 |
Chemical Identifiers
| CAS Number | 83949-85-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N(C)/N=C/C2=[N+](C3=CC=CC=C3C2(C)C)C.CC(=O)[O-] |
Product Overview
Basic Yellow 51 (CAS 83949-85-3), with molecular formula C22H27N3O2 and molecular weight 365.21 g/mol. IUPAC: N,4-dimethyl-N-[(E)-(1,3,3-trimethylindol-1-ium-2-yl)methylideneamino]aniline acetate.
Chemical Property Profile of Basic Yellow 51
Property Insights of Basic Yellow 51
The XLogP value of 2.87942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Basic Yellow 51. With a topological polar surface area (TPSA) of 58.74 Ų, Basic Yellow 51 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Basic Yellow 51 has 0 hydrogen bond donor(s) and 4 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 Basic Yellow 51?
The CAS number of Basic Yellow 51 is 83949-85-3.
What is the molecular formula of Basic Yellow 51?
The molecular formula of Basic Yellow 51 is C22H27N3O2.
What is the molecular weight of Basic Yellow 51?
The molecular weight of Basic Yellow 51 is 365.21 g/mol.
Where can I buy Basic Yellow 51?
You can request a quote for Basic Yellow 51 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Basic Yellow 51?
Yes, KEHONG BIO provides custom synthesis services for Basic Yellow 51 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.