ChemDiv3_001271
TL;DR: ChemDiv3_001271 (CAS 326093-77-0) is a chemical compound with molecular formula C18H15IO5 and molecular weight 438.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-iodo-3-oxo-8,9,10,11-tetrahydro-[1]benzofuro[3,2-f]chromene-2-carboxylate
Also Known As: ChemDiv3_001271, IDI1_020237, AE-848/12123146, ethyl 5-iodo-3-oxo-8,9,10,11-tetrahydro-[1]benzofuro[3,2-f]chromene-2-carboxylate, ethyl 5-iodo-3-oxo-8,9,10,11-tetrahydro-3H-[1]benzofuro[3,2-f]chromene-2-carboxylate
| Molecular Formula | C18H15IO5 |
|---|---|
| Molecular Weight | 438.00 g/mol |
| LogP | 4.1993 |
| Topological Polar Surface Area | 69.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 437.99643 |
| Heavy Atoms | 24 |
| Complexity | 1027.4729 |
Chemical Identifiers
| CAS Number | 326093-77-0 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C3C4=C(CCCC4)OC3=CC(=C2OC1=O)I |
Product Overview
ChemDiv3_001271 (CAS 326093-77-0), with molecular formula C18H15IO5 and molecular weight 438.00 g/mol. IUPAC: ethyl 5-iodo-3-oxo-8,9,10,11-tetrahydro-[1]benzofuro[3,2-f]chromene-2-carboxylate.
Chemical Property Profile of ChemDiv3_001271
Property Insights of ChemDiv3_001271
The XLogP value of 4.1993 indicates that ChemDiv3_001271 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.65 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_001271. Following Lipinski's Rule of Five, ChemDiv3_001271 has 0 hydrogen bond donor(s) and 5 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_001271?
The CAS number of ChemDiv3_001271 is 326093-77-0.
What is the molecular formula of ChemDiv3_001271?
The molecular formula of ChemDiv3_001271 is C18H15IO5.
What is the molecular weight of ChemDiv3_001271?
The molecular weight of ChemDiv3_001271 is 438.00 g/mol.
Where can I buy ChemDiv3_001271?
You can request a quote for ChemDiv3_001271 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_001271?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_001271 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.