(5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate
TL;DR: (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate (CAS 539805-96-4) is a chemical compound with molecular formula C17H13ClN2O2 and molecular weight 312.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate
Also Known As: (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate, 5-chloro-8-quinolinyl methyl(phenyl)carbamate, 5-chloroquinolin-8-yl methyl(phenyl)carbamate, (5-chloro(8-quinolyloxy))-N-methyl-N-benzamide, AP-124/41376178
| Molecular Formula | C17H13ClN2O2 |
|---|---|
| Molecular Weight | 312.07 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.06656 |
| Heavy Atoms | 22 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 539805-96-4 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3 |
| InChIKey | OSGKGELZYPFSPJ-UHFFFAOYSA-N |
Product Overview
(5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate (CAS 539805-96-4), with molecular formula C17H13ClN2O2 and molecular weight 312.07 g/mol. IUPAC: (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate.
Chemical Property Profile of (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate
Property Insights of (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate
The XLogP value of 4.1 indicates that (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate 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-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate?
The CAS number of (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate is 539805-96-4.
What is the molecular formula of (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate?
The molecular formula of (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate is C17H13ClN2O2.
What is the molecular weight of (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate?
The molecular weight of (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate is 312.07 g/mol.
Where can I buy (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate?
You can request a quote for (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for (5-chloroquinolin-8-yl) N-methyl-N-phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.