di-4-Anepps
TL;DR: di-4-Anepps (CAS 96224-26-9) is a chemical compound with molecular formula C28H36N2O3S and molecular weight 480.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[2-[6-(dibutylamino)naphthalen-2-yl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate
Also Known As: di-4-Anepps, Ddpmhu, Di-4-ANEPPS, potentiometric probe, 3-(4-{2-[6-(dibutylamino)naphthalen-2-yl]ethenyl}pyridinium-1-yl)propane-1-sulfonate, 3-(4-(2-(6-(Dibutylamino)naphthalen-2-yl)vinyl)pyridinium-1-yl)propane-1-sulfonate
| Molecular Formula | C28H36N2O3S |
|---|---|
| Molecular Weight | 480.24 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 480.24466 |
| Heavy Atoms | 34 |
| Complexity | 676.0 |
Chemical Identifiers
| CAS Number | 96224-26-9 |
|---|---|
| SMILES | CCCCN(CCCC)C1=CC2=C(C=C1)C=C(C=C2)C=CC3=CC=[N+](C=C3)CCCS(=O)(=O)[O-] |
| InChIKey | HAPJROQJVSPKCJ-UHFFFAOYSA-N |
Product Overview
di-4-Anepps (CAS 96224-26-9), with molecular formula C28H36N2O3S and molecular weight 480.24 g/mol. IUPAC: 3-[4-[2-[6-(dibutylamino)naphthalen-2-yl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate.
Chemical Property Profile of di-4-Anepps
Property Insights of di-4-Anepps
The XLogP value of 6.2 indicates that di-4-Anepps is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for di-4-Anepps. Following Lipinski's Rule of Five, di-4-Anepps has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of di-4-Anepps?
The CAS number of di-4-Anepps is 96224-26-9.
What is the molecular formula of di-4-Anepps?
The molecular formula of di-4-Anepps is C28H36N2O3S.
What is the molecular weight of di-4-Anepps?
The molecular weight of di-4-Anepps is 480.24 g/mol.
Where can I buy di-4-Anepps?
You can request a quote for di-4-Anepps directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for di-4-Anepps?
Yes, KEHONG BIO provides custom synthesis services for di-4-Anepps and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.