ChemDiv1_022645
TL;DR: ChemDiv1_022645 (CAS 471270-86-7) is a chemical compound with molecular formula C28H20BrNO6 and molecular weight 545.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-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_022645, DivK1c_003909, CDS1_002869, 3-(4-bromophenyl)-5-(4-methoxybenzyl)-3a,6a-dihydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6(3H,5H)-tetrone, 1-(4-bromophenyl)-5-[(4-methoxyphenyl)methyl]spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone
| Molecular Formula | C28H20BrNO6 |
|---|---|
| Molecular Weight | 545.05 g/mol |
| LogP | 4.1484 |
| Topological Polar Surface Area | 89.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 545.0474 |
| Heavy Atoms | 36 |
| Complexity | 1396.1538 |
Chemical Identifiers
| CAS Number | 471270-86-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN2C(=O)C3C(C2=O)C4(C(=O)C5=CC=CC=C5C4=O)OC3C6=CC=C(C=C6)Br |
Product Overview
ChemDiv1_022645 (CAS 471270-86-7), with molecular formula C28H20BrNO6 and molecular weight 545.05 g/mol. IUPAC: 1-(4-bromophenyl)-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_022645
Property Insights of ChemDiv1_022645
The XLogP value of 4.1484 indicates that ChemDiv1_022645 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_022645. Following Lipinski's Rule of Five, ChemDiv1_022645 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_022645?
The CAS number of ChemDiv1_022645 is 471270-86-7.
What is the molecular formula of ChemDiv1_022645?
The molecular formula of ChemDiv1_022645 is C28H20BrNO6.
What is the molecular weight of ChemDiv1_022645?
The molecular weight of ChemDiv1_022645 is 545.05 g/mol.
Where can I buy ChemDiv1_022645?
You can request a quote for ChemDiv1_022645 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022645?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022645 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.