ChemDiv1_022590
TL;DR: ChemDiv1_022590 (CAS 470472-56-1) is a chemical compound with molecular formula C27H18BrNO5 and molecular weight 515.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-bromophenyl)-1-(3-methylphenyl)spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone
Also Known As: ChemDiv1_022590, DivK1c_003854, CDS1_002814, BIM-0000522.P001, 5-(2-bromophenyl)-3-(3-methylphenyl)-3a,6a-dihydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6(3H,5H)-tetrone
| Molecular Formula | C27H18BrNO5 |
|---|---|
| Molecular Weight | 515.04 g/mol |
| LogP | 4.45262 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 515.03687 |
| Heavy Atoms | 34 |
| Complexity | 1394.7777 |
Chemical Identifiers
| CAS Number | 470472-56-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2C3C(C(=O)N(C3=O)C4=CC=CC=C4Br)C5(O2)C(=O)C6=CC=CC=C6C5=O |
Product Overview
ChemDiv1_022590 (CAS 470472-56-1), with molecular formula C27H18BrNO5 and molecular weight 515.04 g/mol. IUPAC: 5-(2-bromophenyl)-1-(3-methylphenyl)spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone.
Chemical Property Profile of ChemDiv1_022590
Property Insights of ChemDiv1_022590
The XLogP value of 4.45262 indicates that ChemDiv1_022590 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_022590. Following Lipinski's Rule of Five, ChemDiv1_022590 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_022590?
The CAS number of ChemDiv1_022590 is 470472-56-1.
What is the molecular formula of ChemDiv1_022590?
The molecular formula of ChemDiv1_022590 is C27H18BrNO5.
What is the molecular weight of ChemDiv1_022590?
The molecular weight of ChemDiv1_022590 is 515.04 g/mol.
Where can I buy ChemDiv1_022590?
You can request a quote for ChemDiv1_022590 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022590?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022590 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.