F0721-0171
TL;DR: F0721-0171 (CAS 393840-88-5) is a chemical compound with molecular formula C25H21BrFN5O3S and molecular weight 569.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(4-bromophenyl)-5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-methoxybenzamide
Also Known As: F0721-0171, N-((4-(4-bromophenyl)-5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-2-methoxybenzamide, N-[[4-(4-bromophenyl)-5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-methoxybenzamide, N-{[4-(4-bromophenyl)-5-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-2-methoxybenzamide
| Molecular Formula | C25H21BrFN5O3S |
|---|---|
| Molecular Weight | 569.05 g/mol |
| LogP | 4.8383 |
| Topological Polar Surface Area | 98.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 569.0532 |
| Heavy Atoms | 36 |
| Complexity | 1363.1346 |
Chemical Identifiers
| CAS Number | 393840-88-5 |
|---|---|
| SMILES | COC1=CC=CC=C1C(=O)NCC2=NN=C(N2C3=CC=C(C=C3)Br)SCC(=O)NC4=CC=C(C=C4)F |
Product Overview
F0721-0171 (CAS 393840-88-5), with molecular formula C25H21BrFN5O3S and molecular weight 569.05 g/mol. IUPAC: N-[[4-(4-bromophenyl)-5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-methoxybenzamide.
Chemical Property Profile of F0721-0171
Property Insights of F0721-0171
The XLogP value of 4.8383 indicates that F0721-0171 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.14 Ų falls within the moderate polarity range, balancing permeability and solubility for F0721-0171. Following Lipinski's Rule of Five, F0721-0171 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0721-0171?
The CAS number of F0721-0171 is 393840-88-5.
What is the molecular formula of F0721-0171?
The molecular formula of F0721-0171 is C25H21BrFN5O3S.
What is the molecular weight of F0721-0171?
The molecular weight of F0721-0171 is 569.05 g/mol.
Where can I buy F0721-0171?
You can request a quote for F0721-0171 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0721-0171?
Yes, KEHONG BIO provides custom synthesis services for F0721-0171 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.