F0507-0853
TL;DR: F0507-0853 (CAS 391899-60-8) is a chemical compound with molecular formula C26H18F4N6O2S2 and molecular weight 586.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-2-fluorobenzamide
Also Known As: F0507-0853, N-((5-((2-(benzo[d]thiazol-2-ylamino)-2-oxoethyl)thio)-4-(3-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)methyl)-2-fluorobenzamide, N-{[5-({[(1,3-benzothiazol-2-yl)carbamoyl]methyl}sulfanyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl]methyl}-2-fluorobenzamide, N-[[5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-2-fluorobenzamide, N-({5-[(N-1,3-benzothiazol-2-ylcarbamoyl)methylthio]-4-[m-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}methyl)o-fluorobenzamide
| Molecular Formula | C26H18F4N6O2S2 |
|---|---|
| Molecular Weight | 586.09 g/mol |
| LogP | 5.6957 |
| Topological Polar Surface Area | 101.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 586.08685 |
| Heavy Atoms | 40 |
| Complexity | 1669.1057 |
Chemical Identifiers
| CAS Number | 391899-60-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NCC2=NN=C(N2C3=CC=CC(=C3)C(F)(F)F)SCC(=O)NC4=NC5=CC=CC=C5S4)F |
Product Overview
F0507-0853 (CAS 391899-60-8), with molecular formula C26H18F4N6O2S2 and molecular weight 586.09 g/mol. IUPAC: N-[[5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-2-fluorobenzamide.
Chemical Property Profile of F0507-0853
Property Insights of F0507-0853
The XLogP value of 5.6957 indicates that F0507-0853 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.8 Ų falls within the moderate polarity range, balancing permeability and solubility for F0507-0853. Following Lipinski's Rule of Five, F0507-0853 has 2 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 F0507-0853?
The CAS number of F0507-0853 is 391899-60-8.
What is the molecular formula of F0507-0853?
The molecular formula of F0507-0853 is C26H18F4N6O2S2.
What is the molecular weight of F0507-0853?
The molecular weight of F0507-0853 is 586.09 g/mol.
Where can I buy F0507-0853?
You can request a quote for F0507-0853 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0507-0853?
Yes, KEHONG BIO provides custom synthesis services for F0507-0853 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.