N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide
TL;DR: N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide (CAS 313276-20-9) is a chemical compound with molecular formula C34H32FN3O3 and molecular weight 549.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dimethylphenyl)-N-[2-(1,3-dioxo-6-piperidin-1-ylbenzo[de]isoquinolin-2-yl)ethyl]-4-fluorobenzamide
Also Known As: N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide, N-(2,4-dimethylphenyl)-N-[2-(1,3-dioxo-6-piperidin-1-ylbenzo[de]isoquinolin-2-yl)ethyl]-4-fluorobenzamide
| Molecular Formula | C34H32FN3O3 |
|---|---|
| Molecular Weight | 549.24 g/mol |
| LogP | 6.52904 |
| Topological Polar Surface Area | 60.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 549.2428 |
| Heavy Atoms | 41 |
| Complexity | 1652.9495 |
Chemical Identifiers
| CAS Number | 313276-20-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N(CCN2C(=O)C3=C4C(=C(C=C3)N5CCCCC5)C=CC=C4C2=O)C(=O)C6=CC=C(C=C6)F)C |
Product Overview
N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide (CAS 313276-20-9), with molecular formula C34H32FN3O3 and molecular weight 549.24 g/mol. IUPAC: N-(2,4-dimethylphenyl)-N-[2-(1,3-dioxo-6-piperidin-1-ylbenzo[de]isoquinolin-2-yl)ethyl]-4-fluorobenzamide.
Chemical Property Profile of N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide
Property Insights of N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide
The XLogP value of 6.52904 indicates that N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.93 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide. Following Lipinski's Rule of Five, N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide?
The CAS number of N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide is 313276-20-9.
What is the molecular formula of N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide?
The molecular formula of N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide is C34H32FN3O3.
What is the molecular weight of N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide?
The molecular weight of N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide is 549.24 g/mol.
Where can I buy N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide?
You can request a quote for N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-Dimethylphenyl)-N-[2-[1,3-dioxo-6-(1-piperidinyl)-1H-benz[de]isoquinolin-2(3H)-yl]ethyl]-4-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.