3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one
TL;DR: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one (CAS 610752-06-2) is a chemical compound with molecular formula C29H28O6 and molecular weight 472.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxyphenyl)methoxy]-6-propylchromen-4-one
Also Known As: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one, 3-(2H,3H,4H-benzo[b]1,4-dioxepan-7-yl)-7-[(4-methoxyphenyl)methoxy]-6-propylch romen-4-one, 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxyphenyl)methoxy]-6-propylchromen-4-one, 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-7-((4-methoxybenzyl)oxy)-6-propyl-4H-chromen-4-one
| Molecular Formula | C29H28O6 |
|---|---|
| Molecular Weight | 472.19 g/mol |
| LogP | 6.1614 |
| Topological Polar Surface Area | 67.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 472.1886 |
| Heavy Atoms | 35 |
| Complexity | 1387.2042 |
Chemical Identifiers
| CAS Number | 610752-06-2 |
|---|---|
| SMILES | CCCC1=CC2=C(C=C1OCC3=CC=C(C=C3)OC)OC=C(C2=O)C4=CC5=C(C=C4)OCCCO5 |
Product Overview
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one (CAS 610752-06-2), with molecular formula C29H28O6 and molecular weight 472.19 g/mol. IUPAC: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxyphenyl)methoxy]-6-propylchromen-4-one.
Chemical Property Profile of 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one
Property Insights of 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one
The XLogP value of 6.1614 indicates that 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one. Following Lipinski's Rule of Five, 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one?
The CAS number of 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one is 610752-06-2.
What is the molecular formula of 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one?
The molecular formula of 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one is C29H28O6.
What is the molecular weight of 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one?
The molecular weight of 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one is 472.19 g/mol.
Where can I buy 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one?
You can request a quote for 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(4-methoxybenzyl)oxy]-6-propyl-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.