![(7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one structure](/static/products/831/831179-06-7.png)
(7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one
TL;DR: (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one (CAS 831179-06-7) is a chemical compound with molecular formula C24H16N2O3 and molecular weight 380.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7E)-7-(1,3-benzodioxol-5-ylmethylidene)-12H-isoquinolino[2,3-a]quinazolin-5-one
Also Known As: (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one, (E)-7-(benzo[d][1,3]dioxol-5-ylmethylene)-7,12-dihydro-5H-isoquinolino[2,3-a]quinazolin-5-one, (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-12H-isoquinolino[2,3-a]quinazolin-5-one, 7-(2H-benzo[3,4-d]1,3-dioxolen-5-ylmethylene)-12,13-dihydroisoquinolino[2,3-a] quinazolin-5-one
| Molecular Formula | C24H16N2O3 |
|---|---|
| Molecular Weight | 380.12 g/mol |
| LogP | 4.0758 |
| Topological Polar Surface Area | 53.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 380.1161 |
| Heavy Atoms | 29 |
| Complexity | 1384.7777 |
Chemical Identifiers
| CAS Number | 831179-06-7 |
|---|---|
| SMILES | C1C2=CC=CC=C2/C(=C\C3=CC4=C(C=C3)OCO4)/C5=NC(=O)C6=CC=CC=C6N51 |
Product Overview
(7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one (CAS 831179-06-7), with molecular formula C24H16N2O3 and molecular weight 380.12 g/mol. IUPAC: (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-12H-isoquinolino[2,3-a]quinazolin-5-one.
Chemical Property Profile of (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one
Property Insights of (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one
The XLogP value of 4.0758 indicates that (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.35 Ų, (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one 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 (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one?
The CAS number of (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one is 831179-06-7.
What is the molecular formula of (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one?
The molecular formula of (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one is C24H16N2O3.
What is the molecular weight of (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one?
The molecular weight of (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one is 380.12 g/mol.
Where can I buy (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one?
You can request a quote for (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one?
Yes, KEHONG BIO provides custom synthesis services for (7E)-7-(1,3-benzodioxol-5-ylmethylidene)-7,12-dihydro-5H-isoquino[2,3-a]quinazolin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.