J294.579G
TL;DR: J294.579G (CAS 65151-70-4) is a chemical compound with molecular formula C27H16N2O7S2 and molecular weight 544.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(6-methyl-7-sulfo-1,3-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxoindene-5-carboxylic acid
Also Known As: 2-[6-(6-methyl-7-sulfo-1,3-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxoindene-5-carboxylic acid, 2-[6-(6-methyl-7-sulfo-1,3-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid, 1,3-Dioxo-2-[6-(6-methyl-7-sulfo-2-benzothiazolyl)-2-quinolinyl]-2,3-dihydro-1H-indene-5-carboxylic acid, 2,3-Dihydro-2-[6-(6-methyl-7-sulfo-2-benzothiazolyl)-2-quinolinyl]-1,3-dioxo-1H-indene-5-carboxylic acid, 2-[6-(6-methyl-7-sulfo-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxo-indene-5-carboxylic Acid
| Molecular Formula | C27H16N2O7S2 |
|---|---|
| Molecular Weight | 544.04 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 188.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 544.0399 |
| Heavy Atoms | 38 |
| Complexity | 1090.0 |
Chemical Identifiers
| CAS Number | 65151-70-4 |
|---|---|
| SMILES | CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(C=C4)C5C(=O)C6=C(C5=O)C=C(C=C6)C(=O)O)S(=O)(=O)O |
| InChIKey | UIOFMZLXXNZIKD-UHFFFAOYSA-N |
Product Overview
J294.579G (CAS 65151-70-4), with molecular formula C27H16N2O7S2 and molecular weight 544.04 g/mol. IUPAC: 2-[6-(6-methyl-7-sulfo-1,3-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxoindene-5-carboxylic acid.
Chemical Property Profile of J294.579G
Property Insights of J294.579G
The XLogP value of 4.1 indicates that J294.579G is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 188.0 Ų indicates high polarity, suggesting J294.579G may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, J294.579G has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of J294.579G?
The CAS number of J294.579G is 65151-70-4.
What is the molecular formula of J294.579G?
The molecular formula of J294.579G is C27H16N2O7S2.
What is the molecular weight of J294.579G?
The molecular weight of J294.579G is 544.04 g/mol.
Where can I buy J294.579G?
You can request a quote for J294.579G directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J294.579G?
Yes, KEHONG BIO provides custom synthesis services for J294.579G and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.