![[9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium structure](/static/products/7570/75701-31-4.webp)
[9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium
TL;DR: [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium (CAS 75701-31-4) is a chemical compound with molecular formula C29H31N2O5+ and molecular weight 487.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[9-(2,5-dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium
Also Known As: 9-(2,5-Dicarboxyphenyl)-3,6-bis(diethylamino)xanthylium, [9-(2,5-dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium, [9-(2,5-dicarboxyphenyl)-6-diethylamino-xanthen-3-ylidene]-diethyl-azanium, Xanthylium, 9-(2,5-dicarboxyphenyl)-3,6-bis(diethylamino)-, inner salt, n-[9-(2,5-dicarboxyphenyl)-6-(diethylamino)-3h-xanthen-3-ylidene]-n-ethylethanaminium
| Molecular Formula | C29H31N2O5+ |
|---|---|
| Molecular Weight | 487.22 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 90.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 487.2233 |
| Heavy Atoms | 36 |
| Complexity | 936.0 |
Chemical Identifiers
| CAS Number | 75701-31-4 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=C(C=CC(=C4)C(=O)O)C(=O)O |
| InChIKey | FAOJCBVUFJXHKQ-UHFFFAOYSA-O |
Product Overview
[9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium (CAS 75701-31-4), with molecular formula C29H31N2O5+ and molecular weight 487.22 g/mol. IUPAC: [9-(2,5-dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium.
Chemical Property Profile of [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium
Property Insights of [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium
The XLogP value of 3.9 indicates that [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.1 Ų falls within the moderate polarity range, balancing permeability and solubility for [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium. Following Lipinski's Rule of Five, [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium has 2 hydrogen bond donor(s) and 6 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 [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium?
The CAS number of [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium is 75701-31-4.
What is the molecular formula of [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium?
The molecular formula of [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium is C29H31N2O5+.
What is the molecular weight of [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium?
The molecular weight of [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium is 487.22 g/mol.
Where can I buy [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium?
You can request a quote for [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium?
Yes, KEHONG BIO provides custom synthesis services for [9-(2,5-Dicarboxyphenyl)-6-(diethylamino)xanthen-3-ylidene]-diethylazanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.