BAS 00119489
TL;DR: BAS 00119489 (CAS 5161-31-9) is a chemical compound with molecular formula C31H20N2O7 and molecular weight 532.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methoxyphenyl)-5-[2-(2-methoxyphenyl)-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione
Also Known As: BAS 00119489, BIM-0047951.P001, 5,5'-carbonylbis[2-(2-methoxyphenyl)-1H-isoindole-1,3(2H)-dione], 5,5'-CARBONYLBIS(2-(2-METHOXYPHENYL)ISOINDOLINE-1,3-DIONE), A0937/0043852
| Molecular Formula | C31H20N2O7 |
|---|---|
| Molecular Weight | 532.13 g/mol |
| LogP | 4.536 |
| Topological Polar Surface Area | 110.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 532.1271 |
| Heavy Atoms | 40 |
| Complexity | 1663.4128 |
Chemical Identifiers
| CAS Number | 5161-31-9 |
|---|---|
| SMILES | COC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)C6=CC=CC=C6OC |
Product Overview
BAS 00119489 (CAS 5161-31-9), with molecular formula C31H20N2O7 and molecular weight 532.13 g/mol. IUPAC: 2-(2-methoxyphenyl)-5-[2-(2-methoxyphenyl)-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione.
Chemical Property Profile of BAS 00119489
Property Insights of BAS 00119489
The XLogP value of 4.536 indicates that BAS 00119489 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.29 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00119489. Following Lipinski's Rule of Five, BAS 00119489 has 0 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 00119489?
The CAS number of BAS 00119489 is 5161-31-9.
What is the molecular formula of BAS 00119489?
The molecular formula of BAS 00119489 is C31H20N2O7.
What is the molecular weight of BAS 00119489?
The molecular weight of BAS 00119489 is 532.13 g/mol.
Where can I buy BAS 00119489?
You can request a quote for BAS 00119489 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00119489?
Yes, KEHONG BIO provides custom synthesis services for BAS 00119489 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.