Thioquinapiperifil
TL;DR: Thioquinapiperifil (CAS 220060-39-9) is a chemical compound with molecular formula C24H28N6OS and molecular weight 448.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-8-[[2-[4-(hydroxymethyl)piperidin-1-yl]phenyl]methylamino]-1H-imidazo[4,5-g]quinazoline-2-thione
Also Known As: Thioquinapiperifil, Thioquinapiperfil, KF-31327 free base, Sildenafil Impurity 35, EINECS 244-714-2
| Molecular Formula | C24H28N6OS |
|---|---|
| Molecular Weight | 448.20 g/mol |
| LogP | 4.48279 |
| Topological Polar Surface Area | 82.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 448.20453 |
| Heavy Atoms | 32 |
| Complexity | 1305.0826 |
Chemical Identifiers
| CAS Number | 220060-39-9 |
|---|---|
| SMILES | CCN1C2=C(C=C3C(=C2)N=CN=C3NCC4=CC=CC=C4N5CCC(CC5)CO)NC1=S |
Product Overview
Thioquinapiperifil (CAS 220060-39-9), with molecular formula C24H28N6OS and molecular weight 448.20 g/mol. IUPAC: 3-ethyl-8-[[2-[4-(hydroxymethyl)piperidin-1-yl]phenyl]methylamino]-1H-imidazo[4,5-g]quinazoline-2-thione.
Chemical Property Profile of Thioquinapiperifil
Property Insights of Thioquinapiperifil
The XLogP value of 4.48279 indicates that Thioquinapiperifil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thioquinapiperifil. Following Lipinski's Rule of Five, Thioquinapiperifil has 3 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 Thioquinapiperifil?
The CAS number of Thioquinapiperifil is 220060-39-9.
What is the molecular formula of Thioquinapiperifil?
The molecular formula of Thioquinapiperifil is C24H28N6OS.
What is the molecular weight of Thioquinapiperifil?
The molecular weight of Thioquinapiperifil is 448.20 g/mol.
Where can I buy Thioquinapiperifil?
You can request a quote for Thioquinapiperifil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thioquinapiperifil?
Yes, KEHONG BIO provides custom synthesis services for Thioquinapiperifil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.