F0452-5474
TL;DR: F0452-5474 (CAS 313245-38-4) is a chemical compound with molecular formula C30H16F3N5O3S and molecular weight 583.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-dioxo-2-phenylbenzo[de]isoquinolin-6-yl)-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: F0452-5474, N-(1,3-dioxo-2-phenyl-2,3-dihydro-1H-benzo[de]isoquinolin-6-yl)-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, N-{2,4-dioxo-3-phenyl-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(12),5(13),6,8,10-pentaen-8-yl}-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, N-(1,3-dioxo-2-phenylbenzo[de]isoquinolin-6-yl)-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
| Molecular Formula | C30H16F3N5O3S |
|---|---|
| Molecular Weight | 583.09 g/mol |
| LogP | 6.6827 |
| Topological Polar Surface Area | 96.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 583.0926 |
| Heavy Atoms | 42 |
| Complexity | 2049.5308 |
Chemical Identifiers
| CAS Number | 313245-38-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C3=C4C(=C(C=C3)NC(=O)C5=NN6C(=CC(=NC6=C5)C7=CC=CS7)C(F)(F)F)C=CC=C4C2=O |
Product Overview
F0452-5474 (CAS 313245-38-4), with molecular formula C30H16F3N5O3S and molecular weight 583.09 g/mol. IUPAC: N-(1,3-dioxo-2-phenylbenzo[de]isoquinolin-6-yl)-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of F0452-5474
Property Insights of F0452-5474
The XLogP value of 6.6827 indicates that F0452-5474 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.67 Ų falls within the moderate polarity range, balancing permeability and solubility for F0452-5474. Following Lipinski's Rule of Five, F0452-5474 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0452-5474?
The CAS number of F0452-5474 is 313245-38-4.
What is the molecular formula of F0452-5474?
The molecular formula of F0452-5474 is C30H16F3N5O3S.
What is the molecular weight of F0452-5474?
The molecular weight of F0452-5474 is 583.09 g/mol.
Where can I buy F0452-5474?
You can request a quote for F0452-5474 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0452-5474?
Yes, KEHONG BIO provides custom synthesis services for F0452-5474 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.