1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione
TL;DR: 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione (CAS 438455-50-6) is a chemical compound with molecular formula C22H20F4N2O2 and molecular weight 420.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione
Also Known As: 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione, 1,4-di(3,4-dihydroisoquinolin-2(1H)-yl)-2,2,3,3-tetrafluorobutane-1,4-dione, 1,4-DI[3,4-DIHYDRO-2(1H)-ISOQUINOLINYL]-2,2,3,3-TETRAFLUORO-1,4-BUTANEDIONE, 2-[4-(3,4-dihydro-2(1H)-isoquinolinyl)-2,2,3,3-tetrafluoro-4-oxobutanoyl]-1,2,3,4-tetrahydroisoquinoline
| Molecular Formula | C22H20F4N2O2 |
|---|---|
| Molecular Weight | 420.15 g/mol |
| LogP | 3.4268 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.1461 |
| Heavy Atoms | 30 |
| Complexity | 913.1077 |
Chemical Identifiers
| CAS Number | 438455-50-6 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)C(=O)C(C(C(=O)N3CCC4=CC=CC=C4C3)(F)F)(F)F |
Product Overview
1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione (CAS 438455-50-6), with molecular formula C22H20F4N2O2 and molecular weight 420.15 g/mol. IUPAC: 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione.
Chemical Property Profile of 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione
Property Insights of 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione
The XLogP value of 3.4268 indicates that 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.62 Ų, 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione 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 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione?
The CAS number of 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione is 438455-50-6.
What is the molecular formula of 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione?
The molecular formula of 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione is C22H20F4N2O2.
What is the molecular weight of 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione?
The molecular weight of 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione is 420.15 g/mol.
Where can I buy 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione?
You can request a quote for 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,4-bis(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3-tetrafluorobutane-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.