5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate
TL;DR: 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate (CAS 457650-79-2) is a chemical compound with molecular formula C25H27ClN2O3 and molecular weight 438.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-chloro-7-(morpholin-4-ylmethyl)quinolin-8-yl] 4-tert-butylbenzoate
Also Known As: 5-chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate, [5-chloro-7-(morpholin-4-ylmethyl)quinolin-8-yl] 4-tert-butylbenzoate, 5-chloro-7-[(morpholin-4-yl)methyl]quinolin-8-yl 4-tert-butylbenzoate, F1116-0069, 5-chloro-7-(morpholin-4-ylmethyl)-8-quinolyl 4-(tert-butyl)benzoate
| Molecular Formula | C25H27ClN2O3 |
|---|---|
| Molecular Weight | 438.17 g/mol |
| LogP | 5.2371 |
| Topological Polar Surface Area | 51.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.17102 |
| Heavy Atoms | 31 |
| Complexity | 1084.3577 |
Chemical Identifiers
| CAS Number | 457650-79-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=C3C(=C(C=C2CN4CCOCC4)Cl)C=CC=N3 |
Product Overview
5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate (CAS 457650-79-2), with molecular formula C25H27ClN2O3 and molecular weight 438.17 g/mol. IUPAC: [5-chloro-7-(morpholin-4-ylmethyl)quinolin-8-yl] 4-tert-butylbenzoate.
Chemical Property Profile of 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate
Property Insights of 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate
The XLogP value of 5.2371 indicates that 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.66 Ų, 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate?
The CAS number of 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate is 457650-79-2.
What is the molecular formula of 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate?
The molecular formula of 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate is C25H27ClN2O3.
What is the molecular weight of 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate?
The molecular weight of 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate is 438.17 g/mol.
Where can I buy 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate?
You can request a quote for 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-7-(morpholinomethyl)quinolin-8-yl 4-(tert-butyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.