F3168-1972
TL;DR: F3168-1972 (CAS 688053-89-6) is a chemical compound with molecular formula C21H22N4O4S and molecular weight 426.14 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-(pyridin-3-ylmethyl)hexanamide
Also Known As: F3168-1972, 6-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}-N-[(pyridin-3-yl)methyl]hexanamide, 6-(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)-N-(pyridin-3-ylmethyl)hexanamide, 6-(8-oxo-6-thioxo-5,6-dihydro-[1,3]dioxolo[4,5-g]quinazolin-7(8H)-yl)-N-(pyridin-3-ylmethyl)hexanamide
| Molecular Formula | C21H22N4O4S |
|---|---|
| Molecular Weight | 426.14 g/mol |
| LogP | 3.05959 |
| Topological Polar Surface Area | 98.24 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 426.13617 |
| Heavy Atoms | 30 |
| Complexity | 1173.3253 |
Chemical Identifiers
| CAS Number | 688053-89-6 |
|---|---|
| SMILES | C1OC2=C(O1)C=C3C(=C2)C(=O)N(C(=S)N3)CCCCCC(=O)NCC4=CN=CC=C4 |
Product Overview
F3168-1972 (CAS 688053-89-6), with molecular formula C21H22N4O4S and molecular weight 426.14 g/mol. IUPAC: 6-(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)-N-(pyridin-3-ylmethyl)hexanamide.
Chemical Property Profile of F3168-1972
Property Insights of F3168-1972
The XLogP value of 3.05959 indicates that F3168-1972 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.24 Ų falls within the moderate polarity range, balancing permeability and solubility for F3168-1972. Following Lipinski's Rule of Five, F3168-1972 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3168-1972?
The CAS number of F3168-1972 is 688053-89-6.
What is the molecular formula of F3168-1972?
The molecular formula of F3168-1972 is C21H22N4O4S.
What is the molecular weight of F3168-1972?
The molecular weight of F3168-1972 is 426.14 g/mol.
Where can I buy F3168-1972?
You can request a quote for F3168-1972 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3168-1972?
Yes, KEHONG BIO provides custom synthesis services for F3168-1972 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.