F0507-4848
TL;DR: F0507-4848 (CAS 391940-82-2) is a chemical compound with molecular formula C26H24N6O4S and molecular weight 516.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[[5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-3-nitrobenzamide
Also Known As: F0507-4848, 4-methyl-3-nitro-N-((5-((2-oxo-2-(m-tolylamino)ethyl)thio)-4-phenyl-4H-1,2,4-triazol-3-yl)methyl)benzamide, 4-methyl-N-[[5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-3-nitrobenzamide, 4-methyl-N-{[5-({[(3-methylphenyl)carbamoyl]methyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}-3-nitrobenzamide
| Molecular Formula | C26H24N6O4S |
|---|---|
| Molecular Weight | 516.16 g/mol |
| LogP | 4.45314 |
| Topological Polar Surface Area | 132.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 516.15796 |
| Heavy Atoms | 37 |
| Complexity | 1454.7147 |
Chemical Identifiers
| CAS Number | 391940-82-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-] |
Product Overview
F0507-4848 (CAS 391940-82-2), with molecular formula C26H24N6O4S and molecular weight 516.16 g/mol. IUPAC: 4-methyl-N-[[5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-3-nitrobenzamide.
Chemical Property Profile of F0507-4848
Property Insights of F0507-4848
The XLogP value of 4.45314 indicates that F0507-4848 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.05 Ų falls within the moderate polarity range, balancing permeability and solubility for F0507-4848. Following Lipinski's Rule of Five, F0507-4848 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 F0507-4848?
The CAS number of F0507-4848 is 391940-82-2.
What is the molecular formula of F0507-4848?
The molecular formula of F0507-4848 is C26H24N6O4S.
What is the molecular weight of F0507-4848?
The molecular weight of F0507-4848 is 516.16 g/mol.
Where can I buy F0507-4848?
You can request a quote for F0507-4848 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0507-4848?
Yes, KEHONG BIO provides custom synthesis services for F0507-4848 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.