(4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate
TL;DR: (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate (CAS 858769-27-4) is a chemical compound with molecular formula C23H14O6 and molecular weight 386.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate
Also Known As: VU0617153-1, 4-oxo-3-phenyl-4H-chromen-7-yl 2H-1,3-benzodioxole-5-carboxylate, (4-oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate, 4-oxo-3-phenyl-4H-chromen-7-yl 1,3-benzodioxole-5-carboxylate, F3385-2833
| Molecular Formula | C23H14O6 |
|---|---|
| Molecular Weight | 386.08 g/mol |
| LogP | 4.4079 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.07904 |
| Heavy Atoms | 29 |
| Complexity | 1290.0085 |
Chemical Identifiers
| CAS Number | 858769-27-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C(=O)OC3=CC4=C(C=C3)C(=O)C(=CO4)C5=CC=CC=C5 |
Product Overview
(4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate (CAS 858769-27-4), with molecular formula C23H14O6 and molecular weight 386.08 g/mol. IUPAC: (4-oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate.
Chemical Property Profile of (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate
Property Insights of (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate
The XLogP value of 4.4079 indicates that (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.97 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate. Following Lipinski's Rule of Five, (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate has 0 hydrogen bond donor(s) and 6 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 (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate?
The CAS number of (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate is 858769-27-4.
What is the molecular formula of (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate?
The molecular formula of (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate is C23H14O6.
What is the molecular weight of (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate?
The molecular weight of (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate is 386.08 g/mol.
Where can I buy (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate?
You can request a quote for (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (4-Oxo-3-phenylchromen-7-yl) 1,3-benzodioxole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.