Quinolin-8-yl 3-methylbenzoate
TL;DR: Quinolin-8-yl 3-methylbenzoate (CAS 13607-26-6) is a chemical compound with molecular formula C17H13NO2 and molecular weight 263.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
quinolin-8-yl 3-methylbenzoate
Also Known As: quinolin-8-yl 3-methylbenzoate, 8-quinolyl 3-methylbenzoate, 8-quinolinyl 3-methylbenzoate, Benzoic acid, 3-methyl-, 8-quinolinyl ester, BAS 00119694
| Molecular Formula | C17H13NO2 |
|---|---|
| Molecular Weight | 263.09 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.09464 |
| Heavy Atoms | 20 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 13607-26-6 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)OC2=CC=CC3=C2N=CC=C3 |
| InChIKey | SDPAVXLXSJNZAX-UHFFFAOYSA-N |
Product Overview
Quinolin-8-yl 3-methylbenzoate (CAS 13607-26-6), with molecular formula C17H13NO2 and molecular weight 263.09 g/mol. IUPAC: quinolin-8-yl 3-methylbenzoate.
Chemical Property Profile of Quinolin-8-yl 3-methylbenzoate
Property Insights of Quinolin-8-yl 3-methylbenzoate
The XLogP value of 4.1 indicates that Quinolin-8-yl 3-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.2 Ų, Quinolin-8-yl 3-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinolin-8-yl 3-methylbenzoate 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 Quinolin-8-yl 3-methylbenzoate?
The CAS number of Quinolin-8-yl 3-methylbenzoate is 13607-26-6.
What is the molecular formula of Quinolin-8-yl 3-methylbenzoate?
The molecular formula of Quinolin-8-yl 3-methylbenzoate is C17H13NO2.
What is the molecular weight of Quinolin-8-yl 3-methylbenzoate?
The molecular weight of Quinolin-8-yl 3-methylbenzoate is 263.09 g/mol.
Where can I buy Quinolin-8-yl 3-methylbenzoate?
You can request a quote for Quinolin-8-yl 3-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinolin-8-yl 3-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Quinolin-8-yl 3-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.