J1.659.172F
TL;DR: J1.659.172F (CAS 82473-25-4) is a chemical compound with molecular formula C45H38N2O6 and molecular weight 702.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[4-[2-[4-[4-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: J1.659.172F, 2,2'-[propane-2,2-diylbis(benzene-4,1-diyloxybenzene-4,1-diyl)]bis(3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione), 2,2 -[1-Methyl-1,1-ethanediylbis[(1,4-phenylene)oxy(1,4-phenylene)]]bis(4,7-methano-3a,4,7,7a-tetrahydroisoindoline-1,3-dione), 2,2'-[(1-Methylethylidene)bis(4,1-phenyleneoxy-4,1-phenylene)]bis[3a,4,7,7a-tetrahydro-4,7-methano-1H-isoindole-1,3(2H)-dione], 2,2a(2)-[(1-Methylethylidene)bis(4,1-phenyleneoxy-4,1-phenylene)]bis[3a,4,7,7a-tetrahydro-4,7-methano-1H-isoindole-1,3(2H)-dione]
| Molecular Formula | C45H38N2O6 |
|---|---|
| Molecular Weight | 702.27 g/mol |
| LogP | 8.2201 |
| Topological Polar Surface Area | 93.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 702.273 |
| Heavy Atoms | 53 |
| Complexity | 2019.0121 |
Chemical Identifiers
| CAS Number | 82473-25-4 |
|---|---|
| SMILES | CC(C)(C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4C5CC(C4C3=O)C=C5)C6=CC=C(C=C6)OC7=CC=C(C=C7)N8C(=O)C9C1CC(C9C8=O)C=C1 |
Product Overview
J1.659.172F (CAS 82473-25-4), with molecular formula C45H38N2O6 and molecular weight 702.27 g/mol. IUPAC: 4-[4-[4-[2-[4-[4-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
Chemical Property Profile of J1.659.172F
Property Insights of J1.659.172F
The XLogP value of 8.2201 indicates that J1.659.172F is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.22 Ų falls within the moderate polarity range, balancing permeability and solubility for J1.659.172F. Following Lipinski's Rule of Five, J1.659.172F has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of J1.659.172F?
The CAS number of J1.659.172F is 82473-25-4.
What is the molecular formula of J1.659.172F?
The molecular formula of J1.659.172F is C45H38N2O6.
What is the molecular weight of J1.659.172F?
The molecular weight of J1.659.172F is 702.27 g/mol.
Where can I buy J1.659.172F?
You can request a quote for J1.659.172F directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J1.659.172F?
Yes, KEHONG BIO provides custom synthesis services for J1.659.172F and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.