1,7-Diphenyl-1,4,6-heptatrien-3-one
TL;DR: 1,7-Diphenyl-1,4,6-heptatrien-3-one (CAS 68386-90-3) is a chemical compound with molecular formula C19H16O and molecular weight 260.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1E,4E,6E)-1,7-diphenylhepta-1,4,6-trien-3-one
Also Known As: 1,7-diphenyl-1,4,6-heptatrien-3-one, 1,7-diphenylhepta-1,4,6-trien-3-one, 1,7-Diphenyl-1,4,6-heptatriene-3-one, J1.124.776H, (1E,4E,6E)-1,7-diphenylhepta-1,4,6-trien-3-one
| Molecular Formula | C19H16O |
|---|---|
| Molecular Weight | 260.12 g/mol |
| LogP | 4.5385 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 260.12012 |
| Heavy Atoms | 20 |
| Complexity | 619.3305 |
Chemical Identifiers
| CAS Number | 68386-90-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C=C/C(=O)/C=C/C2=CC=CC=C2 |
Product Overview
1,7-Diphenyl-1,4,6-heptatrien-3-one (CAS 68386-90-3), with molecular formula C19H16O and molecular weight 260.12 g/mol. IUPAC: (1E,4E,6E)-1,7-diphenylhepta-1,4,6-trien-3-one.
Chemical Property Profile of 1,7-Diphenyl-1,4,6-heptatrien-3-one
Property Insights of 1,7-Diphenyl-1,4,6-heptatrien-3-one
The XLogP value of 4.5385 indicates that 1,7-Diphenyl-1,4,6-heptatrien-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1,7-Diphenyl-1,4,6-heptatrien-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,7-Diphenyl-1,4,6-heptatrien-3-one has 0 hydrogen bond donor(s) and 1 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 1,7-Diphenyl-1,4,6-heptatrien-3-one?
The CAS number of 1,7-Diphenyl-1,4,6-heptatrien-3-one is 68386-90-3.
What is the molecular formula of 1,7-Diphenyl-1,4,6-heptatrien-3-one?
The molecular formula of 1,7-Diphenyl-1,4,6-heptatrien-3-one is C19H16O.
What is the molecular weight of 1,7-Diphenyl-1,4,6-heptatrien-3-one?
The molecular weight of 1,7-Diphenyl-1,4,6-heptatrien-3-one is 260.12 g/mol.
Where can I buy 1,7-Diphenyl-1,4,6-heptatrien-3-one?
You can request a quote for 1,7-Diphenyl-1,4,6-heptatrien-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,7-Diphenyl-1,4,6-heptatrien-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1,7-Diphenyl-1,4,6-heptatrien-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.