![5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one structure](/static/products/411/41173-73-3.png)
5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one
TL;DR: 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one (CAS 41173-73-3) is a chemical compound with molecular formula C17H15NO and molecular weight 249.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one
Also Known As: 8-oxoberbine, J3.773.818B, 7,8,12b,13-tetrahydro-5H-6-azatetraphen-5-one, 7,8,12B,13-TETRAHYDRO-6-AZATETRAPHEN-5-ONE, 5,6,13,13a-tetrahydro-8H-dibenzo[a,g]quinolizin-8-one
| Molecular Formula | C17H15NO |
|---|---|
| Molecular Weight | 249.12 g/mol |
| LogP | 2.9823 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 249.11537 |
| Heavy Atoms | 19 |
| Complexity | 661.8166 |
Chemical Identifiers
| CAS Number | 41173-73-3 |
|---|---|
| SMILES | C1CN2C(CC3=CC=CC=C3C2=O)C4=CC=CC=C41 |
Product Overview
5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one (CAS 41173-73-3), with molecular formula C17H15NO and molecular weight 249.12 g/mol. IUPAC: 5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one.
Chemical Property Profile of 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one
Property Insights of 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one
The XLogP value of 2.9823 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one. With a topological polar surface area (TPSA) of 20.31 Ų, 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-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 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one?
The CAS number of 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one is 41173-73-3.
What is the molecular formula of 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one?
The molecular formula of 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one is C17H15NO.
What is the molecular weight of 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one?
The molecular weight of 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one is 249.12 g/mol.
Where can I buy 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one?
You can request a quote for 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one?
Yes, KEHONG BIO provides custom synthesis services for 5,6,13,13a-tetrahydro-8H-isoquino[3,2-a]isoquinolin-8-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.