ChemDiv1_005269
TL;DR: ChemDiv1_005269 (CAS 326007-40-3) is a chemical compound with molecular formula C24H21FN2O4S and molecular weight 452.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione
Also Known As: ChemDiv1_005269, BAS 03353062, BIM-0002867.P001, 2-[[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione, 2-[1-(4-Fluoro-benzenesulfonyl)-piperidin-4-ylmethyl]-benzo[de]isoquinoline-1,3-dione
| Molecular Formula | C24H21FN2O4S |
|---|---|
| Molecular Weight | 452.12 g/mol |
| LogP | 3.6758 |
| Topological Polar Surface Area | 74.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 452.1206 |
| Heavy Atoms | 32 |
| Complexity | 1279.1163 |
Chemical Identifiers
| CAS Number | 326007-40-3 |
|---|---|
| SMILES | C1CN(CCC1CN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)S(=O)(=O)C5=CC=C(C=C5)F |
Product Overview
ChemDiv1_005269 (CAS 326007-40-3), with molecular formula C24H21FN2O4S and molecular weight 452.12 g/mol. IUPAC: 2-[[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of ChemDiv1_005269
Property Insights of ChemDiv1_005269
The XLogP value of 3.6758 indicates that ChemDiv1_005269 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_005269. Following Lipinski's Rule of Five, ChemDiv1_005269 has 0 hydrogen bond donor(s) and 4 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_005269?
The CAS number of ChemDiv1_005269 is 326007-40-3.
What is the molecular formula of ChemDiv1_005269?
The molecular formula of ChemDiv1_005269 is C24H21FN2O4S.
What is the molecular weight of ChemDiv1_005269?
The molecular weight of ChemDiv1_005269 is 452.12 g/mol.
Where can I buy ChemDiv1_005269?
You can request a quote for ChemDiv1_005269 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005269?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005269 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.