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[2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate
TL;DR: [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate (CAS 745021-65-2) is a chemical compound with molecular formula C20H18N2O3 and molecular weight 334.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate
Also Known As: [2-(benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate|2-(Benzylamino)-2-oxoethyl 2-methylquinoline-4-carboxylate|MLS002249764|SMR001317190
| Molecular Formula | C20H18N2O3 |
|---|---|
| Molecular Weight | 334.13 g/mol |
| LogP | 3.01642 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.13174 |
| Heavy Atoms | 25 |
| Complexity | 907.21814 |
Chemical Identifiers
| CAS Number | 745021-65-2 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)NCC3=CC=CC=C3 |
Product Overview
[2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate (CAS 745021-65-2), with molecular formula C20H18N2O3 and molecular weight 334.13 g/mol. IUPAC: [2-(benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate.
Chemical Property Profile of [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate
Property Insights of [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate
The XLogP value of 3.01642 indicates that [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate. Following Lipinski's Rule of Five, [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate has 1 hydrogen bond donor(s) and 4 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 [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate?
The CAS number of [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate is 745021-65-2.
What is the molecular formula of [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate?
The molecular formula of [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate is C20H18N2O3.
What is the molecular weight of [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate?
The molecular weight of [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate is 334.13 g/mol.
Where can I buy [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate?
You can request a quote for [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-(Benzylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.