Vat Yellow 3
TL;DR: Vat Yellow 3 (CAS 82-18-8) is a chemical compound with molecular formula C28H18N2O4 and molecular weight 446.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-benzamido-9,10-dioxoanthracen-1-yl)benzamide
Also Known As: Vat Yellow 3, 1,5-Dibenzamidoanthraquinone, Ponsol Yellow AR, Ponsol Yellow ARD, Endurol Yellow 3G
| Molecular Formula | C28H18N2O4 |
|---|---|
| Molecular Weight | 446.13 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 446.12665 |
| Heavy Atoms | 34 |
| Complexity | 732.0 |
Chemical Identifiers
| CAS Number | 82-18-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC(=O)C5=CC=CC=C5 |
| InChIKey | PZNXLZZWWBSQQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Vat Yellow 3 (CAS 82-18-8), with molecular formula C28H18N2O4 and molecular weight 446.13 g/mol. IUPAC: N-(5-benzamido-9,10-dioxoanthracen-1-yl)benzamide.
Chemical Property Profile of Vat Yellow 3
Property Insights of Vat Yellow 3
The XLogP value of 5.6 indicates that Vat Yellow 3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Vat Yellow 3. Following Lipinski's Rule of Five, Vat Yellow 3 has 2 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 Vat Yellow 3?
The CAS number of Vat Yellow 3 is 82-18-8.
What is the molecular formula of Vat Yellow 3?
The molecular formula of Vat Yellow 3 is C28H18N2O4.
What is the molecular weight of Vat Yellow 3?
The molecular weight of Vat Yellow 3 is 446.13 g/mol.
Where can I buy Vat Yellow 3?
You can request a quote for Vat Yellow 3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vat Yellow 3?
Yes, KEHONG BIO provides custom synthesis services for Vat Yellow 3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.