F0507-4567
TL;DR: F0507-4567 (CAS 391939-10-9) is a chemical compound with molecular formula C27H25ClN6O5S and molecular weight 580.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[[5-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]methyl]-5-nitrobenzamide
Also Known As: F0507-4567, 2-chloro-N-((5-((2-((4-ethoxyphenyl)amino)-2-oxoethyl)thio)-4-(m-tolyl)-4H-1,2,4-triazol-3-yl)methyl)-5-nitrobenzamide, 2-chloro-N-{[5-({[(4-ethoxyphenyl)carbamoyl]methyl}sulfanyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl}-5-nitrobenzamide, 2-chloro-N-[[5-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]methyl]-5-nitrobenzamide
| Molecular Formula | C27H25ClN6O5S |
|---|---|
| Molecular Weight | 580.13 g/mol |
| LogP | 5.19682 |
| Topological Polar Surface Area | 141.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 580.1296 |
| Heavy Atoms | 40 |
| Complexity | 1542.9186 |
Chemical Identifiers
| CAS Number | 391939-10-9 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC(=C3)C)CNC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl |
Product Overview
F0507-4567 (CAS 391939-10-9), with molecular formula C27H25ClN6O5S and molecular weight 580.13 g/mol. IUPAC: 2-chloro-N-[[5-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]methyl]-5-nitrobenzamide.
Chemical Property Profile of F0507-4567
Property Insights of F0507-4567
The XLogP value of 5.19682 indicates that F0507-4567 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.28 Ų indicates high polarity, suggesting F0507-4567 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0507-4567 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0507-4567?
The CAS number of F0507-4567 is 391939-10-9.
What is the molecular formula of F0507-4567?
The molecular formula of F0507-4567 is C27H25ClN6O5S.
What is the molecular weight of F0507-4567?
The molecular weight of F0507-4567 is 580.13 g/mol.
Where can I buy F0507-4567?
You can request a quote for F0507-4567 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0507-4567?
Yes, KEHONG BIO provides custom synthesis services for F0507-4567 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.