F0514-2166
TL;DR: F0514-2166 (CAS 362504-92-5) is a chemical compound with molecular formula C32H26FN7O4S2 and molecular weight 655.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-2-methyl-3-nitrobenzamide
Also Known As: F0514-2166, N-{[5-({2-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}-2-methyl-3-nitrobenzamide, N-((5-((2-(5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl)-2-oxoethyl)thio)-4-phenyl-4H-1,2,4-triazol-3-yl)methyl)-2-methyl-3-nitrobenzamide, N-[[5-[2-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-2-methyl-3-nitrobenzamide
| Molecular Formula | C32H26FN7O4S2 |
|---|---|
| Molecular Weight | 655.15 g/mol |
| LogP | 6.08452 |
| Topological Polar Surface Area | 135.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 655.14716 |
| Heavy Atoms | 46 |
| Complexity | 1929.8099 |
Chemical Identifiers
| CAS Number | 362504-92-5 |
|---|---|
| SMILES | CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)N4C(CC(=N4)C5=CC=CS5)C6=CC=C(C=C6)F |
Product Overview
F0514-2166 (CAS 362504-92-5), with molecular formula C32H26FN7O4S2 and molecular weight 655.15 g/mol. IUPAC: N-[[5-[2-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-2-methyl-3-nitrobenzamide.
Chemical Property Profile of F0514-2166
Property Insights of F0514-2166
The XLogP value of 6.08452 indicates that F0514-2166 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.62 Ų falls within the moderate polarity range, balancing permeability and solubility for F0514-2166. Following Lipinski's Rule of Five, F0514-2166 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0514-2166?
The CAS number of F0514-2166 is 362504-92-5.
What is the molecular formula of F0514-2166?
The molecular formula of F0514-2166 is C32H26FN7O4S2.
What is the molecular weight of F0514-2166?
The molecular weight of F0514-2166 is 655.15 g/mol.
Where can I buy F0514-2166?
You can request a quote for F0514-2166 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0514-2166?
Yes, KEHONG BIO provides custom synthesis services for F0514-2166 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.