Opera_ID_610
TL;DR: Opera_ID_610 (CAS 169903-86-0) is a chemical compound with molecular formula C19H16O6 and molecular weight 340.09 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)-5,7-dihydroxy-2-methylchromen-4-one
Also Known As: IFLab1_000611, IDI1_008830, 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5,7-dihydroxy-2-methylchromen-4-one, 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5,7-dihydroxy-2-methyl-1-benzopyran-4-one, 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5,7-dihydroxy-2-methyl-4H-chromen-4-one
| Molecular Formula | C19H16O6 |
|---|---|
| Molecular Weight | 340.09 g/mol |
| LogP | 3.34092 |
| Topological Polar Surface Area | 89.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 340.0947 |
| Heavy Atoms | 25 |
| Complexity | 1034.2443 |
Chemical Identifiers
| CAS Number | 169903-86-0 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(C=C(C=C2O1)O)O)C3=CC4=C(C=C3)OCCCO4 |
Product Overview
Opera_ID_610 (CAS 169903-86-0), with molecular formula C19H16O6 and molecular weight 340.09 g/mol. IUPAC: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5,7-dihydroxy-2-methylchromen-4-one.
Chemical Property Profile of Opera_ID_610
Property Insights of Opera_ID_610
The XLogP value of 3.34092 indicates that Opera_ID_610 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Opera_ID_610. Following Lipinski's Rule of Five, Opera_ID_610 has 2 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 Opera_ID_610?
The CAS number of Opera_ID_610 is 169903-86-0.
What is the molecular formula of Opera_ID_610?
The molecular formula of Opera_ID_610 is C19H16O6.
What is the molecular weight of Opera_ID_610?
The molecular weight of Opera_ID_610 is 340.09 g/mol.
Where can I buy Opera_ID_610?
You can request a quote for Opera_ID_610 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Opera_ID_610?
Yes, KEHONG BIO provides custom synthesis services for Opera_ID_610 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.