ChemDiv1_005181
TL;DR: ChemDiv1_005181 (CAS 326007-38-9) is a chemical compound with molecular formula C25H24N2O5S and molecular weight 464.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione
Also Known As: ChemDiv1_005181, BAS 03353071, BIM-0003103.P001, VU0058216-3, AF-399/14864077
| Molecular Formula | C25H24N2O5S |
|---|---|
| Molecular Weight | 464.14 g/mol |
| LogP | 3.5453 |
| Topological Polar Surface Area | 83.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 464.1406 |
| Heavy Atoms | 33 |
| Complexity | 1292.2249 |
Chemical Identifiers
| CAS Number | 326007-38-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O |
Product Overview
ChemDiv1_005181 (CAS 326007-38-9), with molecular formula C25H24N2O5S and molecular weight 464.14 g/mol. IUPAC: 2-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of ChemDiv1_005181
Property Insights of ChemDiv1_005181
The XLogP value of 3.5453 indicates that ChemDiv1_005181 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.99 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_005181. Following Lipinski's Rule of Five, ChemDiv1_005181 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_005181?
The CAS number of ChemDiv1_005181 is 326007-38-9.
What is the molecular formula of ChemDiv1_005181?
The molecular formula of ChemDiv1_005181 is C25H24N2O5S.
What is the molecular weight of ChemDiv1_005181?
The molecular weight of ChemDiv1_005181 is 464.14 g/mol.
Where can I buy ChemDiv1_005181?
You can request a quote for ChemDiv1_005181 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005181?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005181 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.