ChemDiv1_022798
TL;DR: ChemDiv1_022798 (CAS 306947-74-0) is a chemical compound with molecular formula C29H20FNO7 and molecular weight 513.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[1-(2-fluorophenyl)-1',3',4,6-tetraoxospiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-5-yl]benzoate
Also Known As: ChemDiv1_022798, DivK1c_004062, CDS1_003022, BAS 00655802, ethyl 4-[1-(2-fluorophenyl)-1',3',4,6-tetraoxospiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-5-yl]benzoate
| Molecular Formula | C29H20FNO7 |
|---|---|
| Molecular Weight | 513.12 g/mol |
| LogP | 3.6975 |
| Topological Polar Surface Area | 107.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 513.1224 |
| Heavy Atoms | 38 |
| Complexity | 1511.4812 |
Chemical Identifiers
| CAS Number | 306947-74-0 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)C4(C(=O)C5=CC=CC=C5C4=O)OC3C6=CC=CC=C6F |
Product Overview
ChemDiv1_022798 (CAS 306947-74-0), with molecular formula C29H20FNO7 and molecular weight 513.12 g/mol. IUPAC: ethyl 4-[1-(2-fluorophenyl)-1',3',4,6-tetraoxospiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-5-yl]benzoate.
Chemical Property Profile of ChemDiv1_022798
Property Insights of ChemDiv1_022798
The XLogP value of 3.6975 indicates that ChemDiv1_022798 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.05 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_022798. Following Lipinski's Rule of Five, ChemDiv1_022798 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_022798?
The CAS number of ChemDiv1_022798 is 306947-74-0.
What is the molecular formula of ChemDiv1_022798?
The molecular formula of ChemDiv1_022798 is C29H20FNO7.
What is the molecular weight of ChemDiv1_022798?
The molecular weight of ChemDiv1_022798 is 513.12 g/mol.
Where can I buy ChemDiv1_022798?
You can request a quote for ChemDiv1_022798 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022798?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022798 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.