BAS 00219183
TL;DR: BAS 00219183 (CAS 105377-29-5) is a chemical compound with molecular formula C31H16N2O9 and molecular weight 560.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-[2-(3-carboxyphenyl)-1,3-dioxoisoindole-5-carbonyl]-1,3-dioxoisoindol-2-yl]benzoic acid
Also Known As: BAS 00219183, 3,3'-[carbonylbis(1,3-dioxo-1,3-dihydro-2H-isoindole-5,2-diyl)]dibenzoic acid, 3,3'-(5,5'-carbonylbis(1,3-dioxoisoindoline-5,2-diyl))dibenzoic acid, 3-[5-[2-(3-carboxyphenyl)-1,3-dioxoisoindole-5-carbonyl]-1,3-dioxoisoindol-2-yl]benzoic acid, 3-(5-{[2-(3-carboxyphenyl)-1,3-dioxobenzo[c]azolidin-5-yl]carbonyl}-1,3-dioxob enzo[c]azolidin-2-yl)benzoic acid
| Molecular Formula | C31H16N2O9 |
|---|---|
| Molecular Weight | 560.09 g/mol |
| LogP | 3.9152 |
| Topological Polar Surface Area | 166.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 560.0856 |
| Heavy Atoms | 42 |
| Complexity | 1820.7319 |
Chemical Identifiers
| CAS Number | 105377-29-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)C6=CC=CC(=C6)C(=O)O)C(=O)O |
Product Overview
BAS 00219183 (CAS 105377-29-5), with molecular formula C31H16N2O9 and molecular weight 560.09 g/mol. IUPAC: 3-[5-[2-(3-carboxyphenyl)-1,3-dioxoisoindole-5-carbonyl]-1,3-dioxoisoindol-2-yl]benzoic acid.
Chemical Property Profile of BAS 00219183
Property Insights of BAS 00219183
The XLogP value of 3.9152 indicates that BAS 00219183 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 166.43 Ų indicates high polarity, suggesting BAS 00219183 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00219183 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00219183?
The CAS number of BAS 00219183 is 105377-29-5.
What is the molecular formula of BAS 00219183?
The molecular formula of BAS 00219183 is C31H16N2O9.
What is the molecular weight of BAS 00219183?
The molecular weight of BAS 00219183 is 560.09 g/mol.
Where can I buy BAS 00219183?
You can request a quote for BAS 00219183 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00219183?
Yes, KEHONG BIO provides custom synthesis services for BAS 00219183 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.