Vat Orange 13
TL;DR: Vat Orange 13 (CAS 6417-38-5) is a chemical compound with molecular formula C43H23N3O7 and molecular weight 693.15 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)-5,8,14-trioxo-13H-anthra[1,2-b]quinoline-10-carboxamide
Also Known As: Vat Orange 13, C.I.Vat Orange 13, Naphth[2,3-c]acridine-10-carboxamide, N-[5-(benzoylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]-5,8,13,14-tetrahydro-5,8,14-trioxo-, N-(5-benzamido-9,10-dioxoanthracen-1-yl)-5,8,14-trioxo-13H-anthra[1,2-b]quinoline-10-carboxamide, n-[5-(benzoylamino)-9,10-dioxo-9,10-dihydroanthracen-1-yl]-5,8,14-trioxo-5,8,13,14-tetrahydronaphtho[2,3-c]acridine-10-carboxamide
| Molecular Formula | C43H23N3O7 |
|---|---|
| Molecular Weight | 693.15 g/mol |
| LogP | 7.6 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 693.1536 |
| Heavy Atoms | 53 |
| Complexity | 1550.0 |
Chemical Identifiers
| CAS Number | 6417-38-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC(=O)C5=CC6=C(C=C5)NC7=C(C6=O)C=CC8=C7C(=O)C9=CC=CC=C9C8=O |
| InChIKey | RBKKSNZUCBLXGH-UHFFFAOYSA-N |
Product Overview
Vat Orange 13 (CAS 6417-38-5), with molecular formula C43H23N3O7 and molecular weight 693.15 g/mol. IUPAC: N-(5-benzamido-9,10-dioxoanthracen-1-yl)-5,8,14-trioxo-13H-anthra[1,2-b]quinoline-10-carboxamide.
Chemical Property Profile of Vat Orange 13
Property Insights of Vat Orange 13
The XLogP value of 7.6 indicates that Vat Orange 13 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 156.0 Ų indicates high polarity, suggesting Vat Orange 13 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Vat Orange 13 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Vat Orange 13?
The CAS number of Vat Orange 13 is 6417-38-5.
What is the molecular formula of Vat Orange 13?
The molecular formula of Vat Orange 13 is C43H23N3O7.
What is the molecular weight of Vat Orange 13?
The molecular weight of Vat Orange 13 is 693.15 g/mol.
Where can I buy Vat Orange 13?
You can request a quote for Vat Orange 13 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vat Orange 13?
Yes, KEHONG BIO provides custom synthesis services for Vat Orange 13 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.