F3168-2027
TL;DR: F3168-2027 (CAS 688055-05-2) is a chemical compound with molecular formula C24H22F3N3O5S and molecular weight 521.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[3-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]-3-oxopropyl]-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-8-one
Also Known As: F3168-2027, 7-(3-{4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl}-3-oxopropyl)-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-8-one, 7-[3-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]-3-oxopropyl]-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-8-one, 7-(3-(4-hydroxy-4-(3-(trifluoromethyl)phenyl)piperidin-1-yl)-3-oxopropyl)-6-thioxo-6,7-dihydro-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one, 7-(3-{4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl}-3-oxopropyl)-6-thioxo-6,7-dihydro[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
| Molecular Formula | C24H22F3N3O5S |
|---|---|
| Molecular Weight | 521.12 g/mol |
| LogP | 3.70689 |
| Topological Polar Surface Area | 96.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 521.1232 |
| Heavy Atoms | 36 |
| Complexity | 1458.0983 |
Chemical Identifiers
| CAS Number | 688055-05-2 |
|---|---|
| SMILES | C1CN(CCC1(C2=CC(=CC=C2)C(F)(F)F)O)C(=O)CCN3C(=O)C4=CC5=C(C=C4NC3=S)OCO5 |
Product Overview
F3168-2027 (CAS 688055-05-2), with molecular formula C24H22F3N3O5S and molecular weight 521.12 g/mol. IUPAC: 7-[3-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]-3-oxopropyl]-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-8-one.
Chemical Property Profile of F3168-2027
Property Insights of F3168-2027
The XLogP value of 3.70689 indicates that F3168-2027 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.79 Ų falls within the moderate polarity range, balancing permeability and solubility for F3168-2027. Following Lipinski's Rule of Five, F3168-2027 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3168-2027?
The CAS number of F3168-2027 is 688055-05-2.
What is the molecular formula of F3168-2027?
The molecular formula of F3168-2027 is C24H22F3N3O5S.
What is the molecular weight of F3168-2027?
The molecular weight of F3168-2027 is 521.12 g/mol.
Where can I buy F3168-2027?
You can request a quote for F3168-2027 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3168-2027?
Yes, KEHONG BIO provides custom synthesis services for F3168-2027 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.