F0507-2016
TL;DR: F0507-2016 (CAS 391917-40-1) is a chemical compound with molecular formula C31H32ClN5O2S and molecular weight 573.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[[4-(3-chlorophenyl)-5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide
Also Known As: F0507-2016, 4-(tert-butyl)-N-((4-(3-chlorophenyl)-5-((2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)benzamide, 4-tert-butyl-N-{[4-(3-chlorophenyl)-5-{[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl]methyl}benzamide, 4-tert-butyl-N-[[4-(3-chlorophenyl)-5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide
| Molecular Formula | C31H32ClN5O2S |
|---|---|
| Molecular Weight | 573.20 g/mol |
| LogP | 6.2197 |
| Topological Polar Surface Area | 80.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 573.19653 |
| Heavy Atoms | 40 |
| Complexity | 1527.4753 |
Chemical Identifiers
| CAS Number | 391917-40-1 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC(=CC=C3)Cl)SCC(=O)N4CCCC5=CC=CC=C54 |
Product Overview
F0507-2016 (CAS 391917-40-1), with molecular formula C31H32ClN5O2S and molecular weight 573.20 g/mol. IUPAC: 4-tert-butyl-N-[[4-(3-chlorophenyl)-5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide.
Chemical Property Profile of F0507-2016
Property Insights of F0507-2016
The XLogP value of 6.2197 indicates that F0507-2016 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.12 Ų falls within the moderate polarity range, balancing permeability and solubility for F0507-2016. Following Lipinski's Rule of Five, F0507-2016 has 1 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 F0507-2016?
The CAS number of F0507-2016 is 391917-40-1.
What is the molecular formula of F0507-2016?
The molecular formula of F0507-2016 is C31H32ClN5O2S.
What is the molecular weight of F0507-2016?
The molecular weight of F0507-2016 is 573.20 g/mol.
Where can I buy F0507-2016?
You can request a quote for F0507-2016 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0507-2016?
Yes, KEHONG BIO provides custom synthesis services for F0507-2016 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.