ChemDiv1_005225
TL;DR: ChemDiv1_005225 (CAS 326007-39-0) is a chemical compound with molecular formula C22H20N2O4S2 and molecular weight 440.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)methyl]benzo[de]isoquinoline-1,3-dione
Also Known As: ChemDiv1_005225, BAS 03353072, BIM-0003516.P001, 2-((1-(thiophen-2-ylsulfonyl)piperidin-4-yl)methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione, F0818-0005
| Molecular Formula | C22H20N2O4S2 |
|---|---|
| Molecular Weight | 440.09 g/mol |
| LogP | 3.5982 |
| Topological Polar Surface Area | 74.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 440.08646 |
| Heavy Atoms | 30 |
| Complexity | 1192.638 |
Chemical Identifiers
| CAS Number | 326007-39-0 |
|---|---|
| SMILES | C1CN(CCC1CN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)S(=O)(=O)C5=CC=CS5 |
Product Overview
ChemDiv1_005225 (CAS 326007-39-0), with molecular formula C22H20N2O4S2 and molecular weight 440.09 g/mol. IUPAC: 2-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)methyl]benzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of ChemDiv1_005225
Property Insights of ChemDiv1_005225
The XLogP value of 3.5982 indicates that ChemDiv1_005225 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.76 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_005225. Following Lipinski's Rule of Five, ChemDiv1_005225 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_005225?
The CAS number of ChemDiv1_005225 is 326007-39-0.
What is the molecular formula of ChemDiv1_005225?
The molecular formula of ChemDiv1_005225 is C22H20N2O4S2.
What is the molecular weight of ChemDiv1_005225?
The molecular weight of ChemDiv1_005225 is 440.09 g/mol.
Where can I buy ChemDiv1_005225?
You can request a quote for ChemDiv1_005225 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005225?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005225 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.