1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)-
TL;DR: 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)- (CAS 97432-38-7) is a chemical compound with molecular formula C21H20O4 and molecular weight 336.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,7-bis(4-methoxyphenyl)hepta-1,6-diene-3,5-dione
Also Known As: NCI60_023033, 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)-, 1,7-bis(4-methoxyphenyl)hepta-1,6-diene-3,5-dione, 1,7-Bis(4-methoxyphenyl)-1,6-heptadiene-3,5-dione, 1,7-Bis-(4-methoxyphenyl)-hepta-1,6-dien-3,5-dione
| Molecular Formula | C21H20O4 |
|---|---|
| Molecular Weight | 336.14 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 336.13617 |
| Heavy Atoms | 25 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 97432-38-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C=CC(=O)CC(=O)C=CC2=CC=C(C=C2)OC |
| InChIKey | JFOLIEXFFOBCSM-UHFFFAOYSA-N |
Product Overview
1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)- (CAS 97432-38-7), with molecular formula C21H20O4 and molecular weight 336.14 g/mol. IUPAC: 1,7-bis(4-methoxyphenyl)hepta-1,6-diene-3,5-dione.
Chemical Property Profile of 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)-
Property Insights of 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)-
The XLogP value of 3.9 indicates that 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)- has 0 hydrogen bond donor(s) and 4 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 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)-?
The CAS number of 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)- is 97432-38-7.
What is the molecular formula of 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)-?
The molecular formula of 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)- is C21H20O4.
What is the molecular weight of 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)-?
The molecular weight of 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)- is 336.14 g/mol.
Where can I buy 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)-?
You can request a quote for 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,6-Heptadiene-3,5-dione, 1,7-bis(4-methoxyphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.