ChemDiv1_021469
TL;DR: ChemDiv1_021469 (CAS 345951-18-0) is a chemical compound with molecular formula C28H20ClNO6 and molecular weight 501.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-5-[(4-methoxyphenyl)methyl]spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone
Also Known As: ChemDiv1_021469, BIM-0034539.P001, 3-(4-chlorophenyl)-5-(4-methoxybenzyl)-3a,6a-dihydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6(3H,5H)-tetrone, 1-(4-chlorophenyl)-5-[(4-methoxyphenyl)methyl]spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone, 3-(4-chlorophenyl)-5-(4-methoxybenzyl)-3,3a-dihydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6(5H,6aH)-tetraone
| Molecular Formula | C28H20ClNO6 |
|---|---|
| Molecular Weight | 501.10 g/mol |
| LogP | 4.0393 |
| Topological Polar Surface Area | 89.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 501.0979 |
| Heavy Atoms | 36 |
| Complexity | 1396.1538 |
Chemical Identifiers
| CAS Number | 345951-18-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN2C(=O)C3C(C2=O)C4(C(=O)C5=CC=CC=C5C4=O)OC3C6=CC=C(C=C6)Cl |
Product Overview
ChemDiv1_021469 (CAS 345951-18-0), with molecular formula C28H20ClNO6 and molecular weight 501.10 g/mol. IUPAC: 1-(4-chlorophenyl)-5-[(4-methoxyphenyl)methyl]spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone.
Chemical Property Profile of ChemDiv1_021469
Property Insights of ChemDiv1_021469
The XLogP value of 4.0393 indicates that ChemDiv1_021469 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.98 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_021469. Following Lipinski's Rule of Five, ChemDiv1_021469 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_021469?
The CAS number of ChemDiv1_021469 is 345951-18-0.
What is the molecular formula of ChemDiv1_021469?
The molecular formula of ChemDiv1_021469 is C28H20ClNO6.
What is the molecular weight of ChemDiv1_021469?
The molecular weight of ChemDiv1_021469 is 501.10 g/mol.
Where can I buy ChemDiv1_021469?
You can request a quote for ChemDiv1_021469 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_021469?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_021469 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.