F0772-0516
TL;DR: F0772-0516 (CAS 309968-40-9) is a chemical compound with molecular formula C31H34N6O6S2 and molecular weight 650.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-4-(2,5-dimethoxyphenyl)-1,2,4-triazol-3-yl]methyl]-4-(dimethylsulfamoyl)benzamide
Also Known As: F0772-0516, N-((5-((2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl)thio)-4-(2,5-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl)methyl)-4-(N,N-dimethylsulfamoyl)benzamide, N-[[5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-4-(2,5-dimethoxyphenyl)-1,2,4-triazol-3-yl]methyl]-4-(dimethylsulfamoyl)benzamide, N-{[4-(2,5-dimethoxyphenyl)-5-{[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl]methyl}-4-(dimethylsulfamoyl)benzamide
| Molecular Formula | C31H34N6O6S2 |
|---|---|
| Molecular Weight | 650.20 g/mol |
| LogP | 3.5363 |
| Topological Polar Surface Area | 135.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 650.1981 |
| Heavy Atoms | 45 |
| Complexity | 1807.4829 |
Chemical Identifiers
| CAS Number | 309968-40-9 |
|---|---|
| SMILES | CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=C(C=CC(=C3)OC)OC)SCC(=O)N4CCCC5=CC=CC=C54 |
Product Overview
F0772-0516 (CAS 309968-40-9), with molecular formula C31H34N6O6S2 and molecular weight 650.20 g/mol. IUPAC: N-[[5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-4-(2,5-dimethoxyphenyl)-1,2,4-triazol-3-yl]methyl]-4-(dimethylsulfamoyl)benzamide.
Chemical Property Profile of F0772-0516
Property Insights of F0772-0516
The XLogP value of 3.5363 indicates that F0772-0516 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.96 Ų falls within the moderate polarity range, balancing permeability and solubility for F0772-0516. Following Lipinski's Rule of Five, F0772-0516 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0772-0516?
The CAS number of F0772-0516 is 309968-40-9.
What is the molecular formula of F0772-0516?
The molecular formula of F0772-0516 is C31H34N6O6S2.
What is the molecular weight of F0772-0516?
The molecular weight of F0772-0516 is 650.20 g/mol.
Where can I buy F0772-0516?
You can request a quote for F0772-0516 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0772-0516?
Yes, KEHONG BIO provides custom synthesis services for F0772-0516 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.