F0791-0054
TL;DR: F0791-0054 (CAS 325699-52-3) is a chemical compound with molecular formula C28H21N3O5 and molecular weight 479.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)iminomethyl]phenyl] 2-oxochromene-3-carboxylate
Also Known As: F0791-0054, (E)-2-(((1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino)methyl)phenyl 2-oxo-2H-chromene-3-carboxylate, [2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)iminomethyl]phenyl] 2-oxochromene-3-carboxylate, 2-[(1E)-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino]methyl]phenyl 2-oxo-2H-chromene-3-carboxylate, [2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)iminomethyl]phenyl] 2-oxochromene-3-carboxylate
| Molecular Formula | C28H21N3O5 |
|---|---|
| Molecular Weight | 479.15 g/mol |
| LogP | 4.56062 |
| Topological Polar Surface Area | 95.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 479.14813 |
| Heavy Atoms | 36 |
| Complexity | 1743.1427 |
Chemical Identifiers
| CAS Number | 325699-52-3 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC=CC=C3OC(=O)C4=CC5=CC=CC=C5OC4=O |
Product Overview
F0791-0054 (CAS 325699-52-3), with molecular formula C28H21N3O5 and molecular weight 479.15 g/mol. IUPAC: [2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)iminomethyl]phenyl] 2-oxochromene-3-carboxylate.
Chemical Property Profile of F0791-0054
Property Insights of F0791-0054
The XLogP value of 4.56062 indicates that F0791-0054 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.8 Ų falls within the moderate polarity range, balancing permeability and solubility for F0791-0054. Following Lipinski's Rule of Five, F0791-0054 has 0 hydrogen bond donor(s) and 6 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 F0791-0054?
The CAS number of F0791-0054 is 325699-52-3.
What is the molecular formula of F0791-0054?
The molecular formula of F0791-0054 is C28H21N3O5.
What is the molecular weight of F0791-0054?
The molecular weight of F0791-0054 is 479.15 g/mol.
Where can I buy F0791-0054?
You can request a quote for F0791-0054 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0791-0054?
Yes, KEHONG BIO provides custom synthesis services for F0791-0054 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.