ChemDiv1_005143
TL;DR: ChemDiv1_005143 (CAS 53193-25-2) is a chemical compound with molecular formula C30H24N2O6S and molecular weight 540.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[4-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)phenyl]sulfonylphenyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: ChemDiv1_005143, F0827-0039, AE-848/32614012, 4-[4-(4-{3,5-dioxo-4-azatricyclo[5.2.1.0^{2,6}]dec-8-en-4-yl}benzenesulfonyl)phenyl]-4-azatricyclo[5.2.1.0^{2,6}]dec-8-ene-3,5-dione, 2,2'-(sulfonylbis(4,1-phenylene))bis(3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione)
| Molecular Formula | C30H24N2O6S |
|---|---|
| Molecular Weight | 540.14 g/mol |
| LogP | 3.1424 |
| Topological Polar Surface Area | 108.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 540.1355 |
| Heavy Atoms | 39 |
| Complexity | 1480.2148 |
Chemical Identifiers
| CAS Number | 53193-25-2 |
|---|---|
| SMILES | C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=C(C=C4)S(=O)(=O)C5=CC=C(C=C5)N6C(=O)C7C8CC(C7C6=O)C=C8 |
Product Overview
ChemDiv1_005143 (CAS 53193-25-2), with molecular formula C30H24N2O6S and molecular weight 540.14 g/mol. IUPAC: 4-[4-[4-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)phenyl]sulfonylphenyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
Chemical Property Profile of ChemDiv1_005143
Property Insights of ChemDiv1_005143
The XLogP value of 3.1424 indicates that ChemDiv1_005143 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.9 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_005143. Following Lipinski's Rule of Five, ChemDiv1_005143 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 ChemDiv1_005143?
The CAS number of ChemDiv1_005143 is 53193-25-2.
What is the molecular formula of ChemDiv1_005143?
The molecular formula of ChemDiv1_005143 is C30H24N2O6S.
What is the molecular weight of ChemDiv1_005143?
The molecular weight of ChemDiv1_005143 is 540.14 g/mol.
Where can I buy ChemDiv1_005143?
You can request a quote for ChemDiv1_005143 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005143?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005143 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.