Vacquinol 1
TL;DR: Vacquinol 1 (CAS 2309312-85-2) is a chemical compound with molecular formula C21H21ClN2O and molecular weight 352.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-chlorophenyl)quinolin-4-yl]-piperidin-2-ylmethanol
Also Known As: Vacquinol 1, Vacquinol-1?, Vacquinol-1 dihydrochloride, (2-(4-chlorophenyl)quinolin-4-yl)(piperidin-2-yl)methanol, [2-(4-chlorophenyl)quinolin-4-yl]-piperidin-2-ylmethanol
| Molecular Formula | C21H21ClN2O |
|---|---|
| Molecular Weight | 352.13 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 45.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.13425 |
| Heavy Atoms | 25 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 2309312-85-2 |
|---|---|
| SMILES | C1CCNC(C1)C(C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl)O |
| InChIKey | VKLJPGAHSLIQKH-UHFFFAOYSA-N |
Product Overview
Vacquinol 1 (CAS 2309312-85-2), with molecular formula C21H21ClN2O and molecular weight 352.13 g/mol. IUPAC: [2-(4-chlorophenyl)quinolin-4-yl]-piperidin-2-ylmethanol.
Chemical Property Profile of Vacquinol 1
Property Insights of Vacquinol 1
The XLogP value of 4.1 indicates that Vacquinol 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.2 Ų, Vacquinol 1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vacquinol 1 has 2 hydrogen bond donor(s) and 3 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 Vacquinol 1?
The CAS number of Vacquinol 1 is 2309312-85-2.
What is the molecular formula of Vacquinol 1?
The molecular formula of Vacquinol 1 is C21H21ClN2O.
What is the molecular weight of Vacquinol 1?
The molecular weight of Vacquinol 1 is 352.13 g/mol.
Where can I buy Vacquinol 1?
You can request a quote for Vacquinol 1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vacquinol 1?
Yes, KEHONG BIO provides custom synthesis services for Vacquinol 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.