2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate
TL;DR: 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate (CAS 1008435-52-6) is a chemical compound with molecular formula C16H18N2O3 and molecular weight 286.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(butan-2-ylamino)-2-oxoethyl] quinoline-2-carboxylate
Also Known As: [(butan-2-yl)carbamoyl]methyl quinoline-2-carboxylate|2-(butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate|[2-(butan-2-ylamino)-2-oxoethyl] quinoline-2-carboxylate|2-(sec-butylamino)-2-oxoethyl quinoline-2-carboxylate|F6609-1916
| Molecular Formula | C16H18N2O3 |
|---|---|
| Molecular Weight | 286.13 g/mol |
| LogP | 2.3063 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.13174 |
| Heavy Atoms | 21 |
| Complexity | 654.7671 |
Chemical Identifiers
| CAS Number | 1008435-52-6 |
|---|---|
| SMILES | CCC(C)NC(=O)COC(=O)C1=NC2=CC=CC=C2C=C1 |
Product Overview
2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate (CAS 1008435-52-6), with molecular formula C16H18N2O3 and molecular weight 286.13 g/mol. IUPAC: [2-(butan-2-ylamino)-2-oxoethyl] quinoline-2-carboxylate.
Chemical Property Profile of 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate
Property Insights of 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate
The XLogP value of 2.3063 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate. Following Lipinski's Rule of Five, 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-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-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate?
The CAS number of 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate is 1008435-52-6.
What is the molecular formula of 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate?
The molecular formula of 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate is C16H18N2O3.
What is the molecular weight of 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate?
The molecular weight of 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate is 286.13 g/mol.
Where can I buy 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate?
You can request a quote for 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Butan-2-ylamino)-2-oxoethyl quinoline-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.