F0508-4857
TL;DR: F0508-4857 (CAS 317328-63-5) is a chemical compound with molecular formula C22H22F3N5O4S2 and molecular weight 541.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-methylsulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide
Also Known As: F0508-4857, N-{[5-(methylsulfanyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl]methyl}-4-(morpholine-4-sulfonyl)benzamide, N-((5-(methylthio)-4-(3-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)methyl)-4-(morpholinosulfonyl)benzamide, N-[[5-methylsulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide, N-{[5-(methylthio)-4-[m-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl]methyl}p-(morpholinosulfonyl)benzamide
| Molecular Formula | C22H22F3N5O4S2 |
|---|---|
| Molecular Weight | 541.11 g/mol |
| LogP | 2.9589 |
| Topological Polar Surface Area | 106.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 541.1065 |
| Heavy Atoms | 36 |
| Complexity | 1338.4586 |
Chemical Identifiers
| CAS Number | 317328-63-5 |
|---|---|
| SMILES | CSC1=NN=C(N1C2=CC=CC(=C2)C(F)(F)F)CNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4 |
Product Overview
F0508-4857 (CAS 317328-63-5), with molecular formula C22H22F3N5O4S2 and molecular weight 541.11 g/mol. IUPAC: N-[[5-methylsulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide.
Chemical Property Profile of F0508-4857
Property Insights of F0508-4857
The XLogP value of 2.9589 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0508-4857. The TPSA of 106.42 Ų falls within the moderate polarity range, balancing permeability and solubility for F0508-4857. Following Lipinski's Rule of Five, F0508-4857 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 F0508-4857?
The CAS number of F0508-4857 is 317328-63-5.
What is the molecular formula of F0508-4857?
The molecular formula of F0508-4857 is C22H22F3N5O4S2.
What is the molecular weight of F0508-4857?
The molecular weight of F0508-4857 is 541.11 g/mol.
Where can I buy F0508-4857?
You can request a quote for F0508-4857 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0508-4857?
Yes, KEHONG BIO provides custom synthesis services for F0508-4857 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.