ChemDiv1_022526
TL;DR: ChemDiv1_022526 (CAS 459789-72-1) is a chemical compound with molecular formula C26H22ClNO5 and molecular weight 463.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-5-cyclohexylspiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone
Also Known As: ChemDiv1_022526, BAS 00219378, AB00079915-01, 1-(4-chlorophenyl)-5-cyclohexylspiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone, 1-(4-chlorophenyl)-5-cyclohexyl-3a,6a-dihydrospiro{1H-furo[3,4-c]pyrrole-3,2'(1'H)-indene}-1',3',4,6(2'H,3H,5H)-tetrone
| Molecular Formula | C26H22ClNO5 |
|---|---|
| Molecular Weight | 463.12 g/mol |
| LogP | 4.1632 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 463.11865 |
| Heavy Atoms | 33 |
| Complexity | 1164.4178 |
Chemical Identifiers
| CAS Number | 459789-72-1 |
|---|---|
| SMILES | C1CCC(CC1)N2C(=O)C3C(C2=O)C4(C(=O)C5=CC=CC=C5C4=O)OC3C6=CC=C(C=C6)Cl |
Product Overview
ChemDiv1_022526 (CAS 459789-72-1), with molecular formula C26H22ClNO5 and molecular weight 463.12 g/mol. IUPAC: 1-(4-chlorophenyl)-5-cyclohexylspiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone.
Chemical Property Profile of ChemDiv1_022526
Property Insights of ChemDiv1_022526
The XLogP value of 4.1632 indicates that ChemDiv1_022526 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_022526. Following Lipinski's Rule of Five, ChemDiv1_022526 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_022526?
The CAS number of ChemDiv1_022526 is 459789-72-1.
What is the molecular formula of ChemDiv1_022526?
The molecular formula of ChemDiv1_022526 is C26H22ClNO5.
What is the molecular weight of ChemDiv1_022526?
The molecular weight of ChemDiv1_022526 is 463.12 g/mol.
Where can I buy ChemDiv1_022526?
You can request a quote for ChemDiv1_022526 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022526?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022526 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.