ChemDiv3_006783
TL;DR: ChemDiv3_006783 (CAS 610758-92-4) is a chemical compound with molecular formula C22H20O7 and molecular weight 396.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate
Also Known As: ChemDiv3_006783, IDI1_024693, ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate, VU0042812-5, BRD-K75530340-001-01-8
| Molecular Formula | C22H20O7 |
|---|---|
| Molecular Weight | 396.12 g/mol |
| LogP | 3.6759 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.1209 |
| Heavy Atoms | 29 |
| Complexity | 1160.015 |
Chemical Identifiers
| CAS Number | 610758-92-4 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1O)OC(=C(C2=O)C3=CC4=C(C=C3)OCCO4)C(=O)OCC |
Product Overview
ChemDiv3_006783 (CAS 610758-92-4), with molecular formula C22H20O7 and molecular weight 396.12 g/mol. IUPAC: ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate.
Chemical Property Profile of ChemDiv3_006783
Property Insights of ChemDiv3_006783
The XLogP value of 3.6759 indicates that ChemDiv3_006783 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_006783. Following Lipinski's Rule of Five, ChemDiv3_006783 has 1 hydrogen bond donor(s) and 7 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 ChemDiv3_006783?
The CAS number of ChemDiv3_006783 is 610758-92-4.
What is the molecular formula of ChemDiv3_006783?
The molecular formula of ChemDiv3_006783 is C22H20O7.
What is the molecular weight of ChemDiv3_006783?
The molecular weight of ChemDiv3_006783 is 396.12 g/mol.
Where can I buy ChemDiv3_006783?
You can request a quote for ChemDiv3_006783 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_006783?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_006783 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.