1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone
TL;DR: 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone (CAS 61925-59-5) is a chemical compound with molecular formula C19H14O5 and molecular weight 322.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-bis(1,3-benzodioxol-5-yl)penta-1,4-dien-3-one
Also Known As: Lin-benzo-ADP, Dipiperonylidenaceton, ChemDiv3_005248, Linear-benzoadenosine diphosphate, 1,5-BIS-(1,3-BENZODIOXOL-5-YL)-3-PENTADIENONE
| Molecular Formula | C19H14O5 |
|---|---|
| Molecular Weight | 322.08 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.08414 |
| Heavy Atoms | 24 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 61925-59-5 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C=CC(=O)C=CC3=CC4=C(C=C3)OCO4 |
| InChIKey | UHDVKUQJNWLHLT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone (CAS 61925-59-5), with molecular formula C19H14O5 and molecular weight 322.08 g/mol. IUPAC: 1,5-bis(1,3-benzodioxol-5-yl)penta-1,4-dien-3-one.
Chemical Property Profile of 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone
Property Insights of 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone
The XLogP value of 3.7 indicates that 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone has 0 hydrogen bond donor(s) and 5 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 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone?
The CAS number of 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone is 61925-59-5.
What is the molecular formula of 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone?
The molecular formula of 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone is C19H14O5.
What is the molecular weight of 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone?
The molecular weight of 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone is 322.08 g/mol.
Where can I buy 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone?
You can request a quote for 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Bis-(1,3-benzodioxol-5-YL)-3-pentadienone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.