5-Chloro-8-quinolyl pyrrolidinecarboxylate
TL;DR: 5-Chloro-8-quinolyl pyrrolidinecarboxylate (CAS 494779-63-4) is a chemical compound with molecular formula C14H13ClN2O2 and molecular weight 276.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-chloroquinolin-8-yl) pyrrolidine-1-carboxylate
Also Known As: 5-chloro-8-quinolyl pyrrolidinecarboxylate, BAS 08196476, 5-chloro-8-quinolinyl 1-pyrrolidinecarboxylate, (5-chloroquinolin-8-yl) pyrrolidine-1-carboxylate, Pyrrolidine-1-carboxylic acid 5-chloro-quinolin-8-yl ester
| Molecular Formula | C14H13ClN2O2 |
|---|---|
| Molecular Weight | 276.07 g/mol |
| LogP | 3.4828 |
| Topological Polar Surface Area | 42.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 276.06656 |
| Heavy Atoms | 19 |
| Complexity | 623.87213 |
Chemical Identifiers
| CAS Number | 494779-63-4 |
|---|---|
| SMILES | C1CCN(C1)C(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3 |
Product Overview
5-Chloro-8-quinolyl pyrrolidinecarboxylate (CAS 494779-63-4), with molecular formula C14H13ClN2O2 and molecular weight 276.07 g/mol. IUPAC: (5-chloroquinolin-8-yl) pyrrolidine-1-carboxylate.
Chemical Property Profile of 5-Chloro-8-quinolyl pyrrolidinecarboxylate
Property Insights of 5-Chloro-8-quinolyl pyrrolidinecarboxylate
The XLogP value of 3.4828 indicates that 5-Chloro-8-quinolyl pyrrolidinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.43 Ų, 5-Chloro-8-quinolyl pyrrolidinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-8-quinolyl pyrrolidinecarboxylate has 0 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 5-Chloro-8-quinolyl pyrrolidinecarboxylate?
The CAS number of 5-Chloro-8-quinolyl pyrrolidinecarboxylate is 494779-63-4.
What is the molecular formula of 5-Chloro-8-quinolyl pyrrolidinecarboxylate?
The molecular formula of 5-Chloro-8-quinolyl pyrrolidinecarboxylate is C14H13ClN2O2.
What is the molecular weight of 5-Chloro-8-quinolyl pyrrolidinecarboxylate?
The molecular weight of 5-Chloro-8-quinolyl pyrrolidinecarboxylate is 276.07 g/mol.
Where can I buy 5-Chloro-8-quinolyl pyrrolidinecarboxylate?
You can request a quote for 5-Chloro-8-quinolyl pyrrolidinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-8-quinolyl pyrrolidinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-8-quinolyl pyrrolidinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.