F0721-0038
TL;DR: F0721-0038 (CAS 393839-58-2) is a chemical compound with molecular formula C25H18ClF4N5O2S and molecular weight 563.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]benzamide
Also Known As: F0721-0038, N-({5-[({[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl}methyl)benzamide, N-[[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]benzamide, N-({5-[(2-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-2-oxoethyl)sulfanyl]-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl}methyl)benzamide, N-((5-((2-((2-chloro-5-(trifluoromethyl)phenyl)amino)-2-oxoethyl)thio)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl)methyl)benzamide
| Molecular Formula | C25H18ClF4N5O2S |
|---|---|
| Molecular Weight | 563.08 g/mol |
| LogP | 5.7394 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 563.08057 |
| Heavy Atoms | 38 |
| Complexity | 1446.6415 |
Chemical Identifiers
| CAS Number | 393839-58-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=C(C=C3)F)SCC(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl |
Product Overview
F0721-0038 (CAS 393839-58-2), with molecular formula C25H18ClF4N5O2S and molecular weight 563.08 g/mol. IUPAC: N-[[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]benzamide.
Chemical Property Profile of F0721-0038
Property Insights of F0721-0038
The XLogP value of 5.7394 indicates that F0721-0038 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.91 Ų falls within the moderate polarity range, balancing permeability and solubility for F0721-0038. Following Lipinski's Rule of Five, F0721-0038 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0721-0038?
The CAS number of F0721-0038 is 393839-58-2.
What is the molecular formula of F0721-0038?
The molecular formula of F0721-0038 is C25H18ClF4N5O2S.
What is the molecular weight of F0721-0038?
The molecular weight of F0721-0038 is 563.08 g/mol.
Where can I buy F0721-0038?
You can request a quote for F0721-0038 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0721-0038?
Yes, KEHONG BIO provides custom synthesis services for F0721-0038 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.