F3168-1971
TL;DR: F3168-1971 (CAS 688053-85-2) is a chemical compound with molecular formula C23H26N4O6S2 and molecular weight 518.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)-N-[2-(4-sulfamoylphenyl)ethyl]hexanamide
Also Known As: F3168-1971, 6-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}-N-[2-(4-sulfamoylphenyl)ethyl]hexanamide, 6-(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)-N-[2-(4-sulfamoylphenyl)ethyl]hexanamide, 6-(8-oxo-6-thioxo-5,6-dihydro-[1,3]dioxolo[4,5-g]quinazolin-7(8H)-yl)-N-(4-sulfamoylphenethyl)hexanamide
| Molecular Formula | C23H26N4O6S2 |
|---|---|
| Molecular Weight | 518.13 g/mol |
| LogP | 2.35449 |
| Topological Polar Surface Area | 145.51 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 518.1294 |
| Heavy Atoms | 35 |
| Complexity | 1462.3403 |
Chemical Identifiers
| CAS Number | 688053-85-2 |
|---|---|
| SMILES | C1OC2=C(O1)C=C3C(=C2)C(=O)N(C(=S)N3)CCCCCC(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N |
Product Overview
F3168-1971 (CAS 688053-85-2), with molecular formula C23H26N4O6S2 and molecular weight 518.13 g/mol. IUPAC: 6-(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)-N-[2-(4-sulfamoylphenyl)ethyl]hexanamide.
Chemical Property Profile of F3168-1971
Property Insights of F3168-1971
The XLogP value of 2.35449 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F3168-1971. The TPSA of 145.51 Ų indicates high polarity, suggesting F3168-1971 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F3168-1971 has 3 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 F3168-1971?
The CAS number of F3168-1971 is 688053-85-2.
What is the molecular formula of F3168-1971?
The molecular formula of F3168-1971 is C23H26N4O6S2.
What is the molecular weight of F3168-1971?
The molecular weight of F3168-1971 is 518.13 g/mol.
Where can I buy F3168-1971?
You can request a quote for F3168-1971 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3168-1971?
Yes, KEHONG BIO provides custom synthesis services for F3168-1971 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.