F0508-0111
TL;DR: F0508-0111 (CAS 389071-25-4) is a chemical compound with molecular formula C25H19Cl2N5O4S and molecular weight 555.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(3,4-dichlorophenyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]methyl]-2-methyl-3-nitrobenzamide
Also Known As: F0508-0111, N-((4-(3,4-dichlorophenyl)-5-((2-oxo-2-phenylethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-2-methyl-3-nitrobenzamide, N-{[4-(3,4-dichlorophenyl)-5-[(2-oxo-2-phenylethyl)sulfanyl]-4H-1,2,4-triazol-3-yl]methyl}-2-methyl-3-nitrobenzamide, N-[[4-(3,4-dichlorophenyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]methyl]-2-methyl-3-nitrobenzamide
| Molecular Formula | C25H19Cl2N5O4S |
|---|---|
| Molecular Weight | 555.05 g/mol |
| LogP | 5.69572 |
| Topological Polar Surface Area | 120.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 555.05347 |
| Heavy Atoms | 37 |
| Complexity | 1493.9427 |
Chemical Identifiers
| CAS Number | 389071-25-4 |
|---|---|
| SMILES | CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2=NN=C(N2C3=CC(=C(C=C3)Cl)Cl)SCC(=O)C4=CC=CC=C4 |
Product Overview
F0508-0111 (CAS 389071-25-4), with molecular formula C25H19Cl2N5O4S and molecular weight 555.05 g/mol. IUPAC: N-[[4-(3,4-dichlorophenyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]methyl]-2-methyl-3-nitrobenzamide.
Chemical Property Profile of F0508-0111
Property Insights of F0508-0111
The XLogP value of 5.69572 indicates that F0508-0111 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.02 Ų falls within the moderate polarity range, balancing permeability and solubility for F0508-0111. Following Lipinski's Rule of Five, F0508-0111 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0508-0111?
The CAS number of F0508-0111 is 389071-25-4.
What is the molecular formula of F0508-0111?
The molecular formula of F0508-0111 is C25H19Cl2N5O4S.
What is the molecular weight of F0508-0111?
The molecular weight of F0508-0111 is 555.05 g/mol.
Where can I buy F0508-0111?
You can request a quote for F0508-0111 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0508-0111?
Yes, KEHONG BIO provides custom synthesis services for F0508-0111 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.