F0721-0464
TL;DR: F0721-0464 (CAS 393872-76-9) is a chemical compound with molecular formula C27H23BrN6O4S and molecular weight 606.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(4-bromophenyl)-5-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-methyl-3-nitrobenzamide
Also Known As: F0721-0464, N-((4-(4-bromophenyl)-5-((2-(indolin-1-yl)-2-oxoethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-2-methyl-3-nitrobenzamide, N-{[4-(4-bromophenyl)-5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl]methyl}-2-methyl-3-nitrobenzamide, N-[[4-(4-bromophenyl)-5-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-methyl-3-nitrobenzamide
| Molecular Formula | C27H23BrN6O4S |
|---|---|
| Molecular Weight | 606.07 g/mol |
| LogP | 4.85782 |
| Topological Polar Surface Area | 123.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 606.0685 |
| Heavy Atoms | 39 |
| Complexity | 1573.003 |
Chemical Identifiers
| CAS Number | 393872-76-9 |
|---|---|
| SMILES | CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2=NN=C(N2C3=CC=C(C=C3)Br)SCC(=O)N4CCC5=CC=CC=C54 |
Product Overview
F0721-0464 (CAS 393872-76-9), with molecular formula C27H23BrN6O4S and molecular weight 606.07 g/mol. IUPAC: N-[[4-(4-bromophenyl)-5-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-methyl-3-nitrobenzamide.
Chemical Property Profile of F0721-0464
Property Insights of F0721-0464
The XLogP value of 4.85782 indicates that F0721-0464 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.26 Ų falls within the moderate polarity range, balancing permeability and solubility for F0721-0464. Following Lipinski's Rule of Five, F0721-0464 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 F0721-0464?
The CAS number of F0721-0464 is 393872-76-9.
What is the molecular formula of F0721-0464?
The molecular formula of F0721-0464 is C27H23BrN6O4S.
What is the molecular weight of F0721-0464?
The molecular weight of F0721-0464 is 606.07 g/mol.
Where can I buy F0721-0464?
You can request a quote for F0721-0464 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0721-0464?
Yes, KEHONG BIO provides custom synthesis services for F0721-0464 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.