BAS 00298178
TL;DR: BAS 00298178 (CAS 330971-40-9) is a chemical compound with molecular formula C32H16N2O14S and molecular weight 684.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[5-[2-(3,5-dicarboxyphenyl)-1,3-dioxoisoindol-5-yl]sulfonyl-1,3-dioxoisoindol-2-yl]benzene-1,3-dicarboxylic acid
Also Known As: BAS 00298178, 5,5'-[sulfonylbis(1,3-dioxo-1,3-dihydro-2H-isoindole-5,2-diyl)]diisophthalic acid, 5,5'-(Sulfonylbis(1,3-dioxoisoindoline-5,2-diyl))diisophthalic acid, 5-[5-[2-(3,5-dicarboxyphenyl)-1,3-dioxoisoindol-5-yl]sulfonyl-1,3-dioxoisoindol-2-yl]benzene-1,3-dicarboxylic acid
| Molecular Formula | C32H16N2O14S |
|---|---|
| Molecular Weight | 684.03 g/mol |
| LogP | 2.9134 |
| Topological Polar Surface Area | 258.1 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 684.0322 |
| Heavy Atoms | 49 |
| Complexity | 2188.6372 |
Chemical Identifiers
| CAS Number | 330971-40-9 |
|---|---|
| SMILES | C1=CC2=C(C=C1S(=O)(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC(=CC(=C5)C(=O)O)C(=O)O)C(=O)N(C2=O)C6=CC(=CC(=C6)C(=O)O)C(=O)O |
Product Overview
BAS 00298178 (CAS 330971-40-9), with molecular formula C32H16N2O14S and molecular weight 684.03 g/mol. IUPAC: 5-[5-[2-(3,5-dicarboxyphenyl)-1,3-dioxoisoindol-5-yl]sulfonyl-1,3-dioxoisoindol-2-yl]benzene-1,3-dicarboxylic acid.
Chemical Property Profile of BAS 00298178
Property Insights of BAS 00298178
The XLogP value of 2.9134 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00298178. The TPSA of 258.1 Ų indicates high polarity, suggesting BAS 00298178 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00298178 has 4 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 BAS 00298178?
The CAS number of BAS 00298178 is 330971-40-9.
What is the molecular formula of BAS 00298178?
The molecular formula of BAS 00298178 is C32H16N2O14S.
What is the molecular weight of BAS 00298178?
The molecular weight of BAS 00298178 is 684.03 g/mol.
Where can I buy BAS 00298178?
You can request a quote for BAS 00298178 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00298178?
Yes, KEHONG BIO provides custom synthesis services for BAS 00298178 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.