2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline
TL;DR: 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline (CAS 34579-55-0) is a chemical compound with molecular formula C21H17NO2 and molecular weight 315.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(5-methylfuran-2-yl)-1H-isoquinolin-2-yl]-phenylmethanone
Also Known As: 2-benzoyl-1-1,2-dihydroisoquinoline, 2-benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline, EC-000.1779, 2-BENZOYL-1- -1,2-DIHYDROISOQUINOLINE, 2-Benzoyl-1-(5-methyl-2-furyl)-2(1H)-isoquinoline
| Molecular Formula | C21H17NO2 |
|---|---|
| Molecular Weight | 315.13 g/mol |
| LogP | 4.80412 |
| Topological Polar Surface Area | 33.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 315.12592 |
| Heavy Atoms | 24 |
| Complexity | 908.3529 |
Chemical Identifiers
| CAS Number | 34579-55-0 |
|---|---|
| SMILES | CC1=CC=C(O1)C2C3=CC=CC=C3C=CN2C(=O)C4=CC=CC=C4 |
Product Overview
2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline (CAS 34579-55-0), with molecular formula C21H17NO2 and molecular weight 315.13 g/mol. IUPAC: [1-(5-methylfuran-2-yl)-1H-isoquinolin-2-yl]-phenylmethanone.
Chemical Property Profile of 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline
Property Insights of 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline
The XLogP value of 4.80412 indicates that 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.45 Ų, 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline has 0 hydrogen bond donor(s) and 2 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 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline?
The CAS number of 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline is 34579-55-0.
What is the molecular formula of 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline?
The molecular formula of 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline is C21H17NO2.
What is the molecular weight of 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline?
The molecular weight of 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline is 315.13 g/mol.
Where can I buy 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline?
You can request a quote for 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzoyl-1-(5-methyl-2-furyl)-1,2-dihydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.