F0721-0279
TL;DR: F0721-0279 (CAS 393870-91-2) is a chemical compound with molecular formula C29H27F4N5O2S and molecular weight 585.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]benzamide
Also Known As: F0721-0279, 4-tert-butyl-N-{[5-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl]methyl}benzamide, 4-(tert-butyl)-N-((5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-4-(3-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)methyl)benzamide, 4-tert-butyl-N-[[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]benzamide
| Molecular Formula | C29H27F4N5O2S |
|---|---|
| Molecular Weight | 585.18 g/mol |
| LogP | 6.3835 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 585.1821 |
| Heavy Atoms | 41 |
| Complexity | 1528.7949 |
Chemical Identifiers
| CAS Number | 393870-91-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC(=C3)C(F)(F)F)SCC(=O)NC4=CC=C(C=C4)F |
Product Overview
F0721-0279 (CAS 393870-91-2), with molecular formula C29H27F4N5O2S and molecular weight 585.18 g/mol. IUPAC: 4-tert-butyl-N-[[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]benzamide.
Chemical Property Profile of F0721-0279
Property Insights of F0721-0279
The XLogP value of 6.3835 indicates that F0721-0279 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 F0721-0279. Following Lipinski's Rule of Five, F0721-0279 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 F0721-0279?
The CAS number of F0721-0279 is 393870-91-2.
What is the molecular formula of F0721-0279?
The molecular formula of F0721-0279 is C29H27F4N5O2S.
What is the molecular weight of F0721-0279?
The molecular weight of F0721-0279 is 585.18 g/mol.
Where can I buy F0721-0279?
You can request a quote for F0721-0279 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0721-0279?
Yes, KEHONG BIO provides custom synthesis services for F0721-0279 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.