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Boc-3-(3-quinolyl)-DL-Ala-OH structure
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Boc-3-(3-quinolyl)-DL-Ala-OH

TL;DR: Boc-3-(3-quinolyl)-DL-Ala-OH (CAS 135101-19-8) is a chemical compound with molecular formula C17H20N2O4 and molecular weight 316.1423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-quinolin-3-ylpropanoic acid

Also Known As: Boc-3-(3-quinolyl)-DL-Ala-OH, Boc-3-(3-quinolyl)-DL-alanine, HY-W141845, a-(Boc-amino)-3-quinolinepropanoic acid, BOC-3-(3'-QUINOLYL)-L-ALANINE

CAS Number
135101-19-8
Molecular Formula
C17H20N2O4
Molecular Weight
316.1423 g/mol
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Technical Specifications

Molecular FormulaC17H20N2O4
Molecular Weight316.1423 g/mol
XLogP2.8
Topological Polar Surface Area (TPSA)88.5 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds6
Exact Mass316.1423 Da
Heavy Atoms23
Complexity433.0
SMILESCC(C)(C)OC(=O)NC(CC1=CC2=CC=CC=C2N=C1)C(=O)O
InChIKeyZJIPRFVJGMPMPL-UHFFFAOYSA-N

Chemical Property Profile of Boc-3-(3-quinolyl)-DL-Ala-OH

XLogP
2.8
TPSA (Topological Polar Surface Area)
88.5
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
6
Heavy Atoms
23
Complexity
433.0
Exact Mass
316.1423
Monoisotopic Mass
316.1423
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Boc-3-(3-quinolyl)-DL-Ala-OH

The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-3-(3-quinolyl)-DL-Ala-OH. The TPSA of 88.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-3-(3-quinolyl)-DL-Ala-OH. Following Lipinski's Rule of Five, Boc-3-(3-quinolyl)-DL-Ala-OH has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Boc-3-(3-quinolyl)-DL-Ala-OH?

The CAS number of Boc-3-(3-quinolyl)-DL-Ala-OH is 135101-19-8.

What is the molecular formula of Boc-3-(3-quinolyl)-DL-Ala-OH?

The molecular formula of Boc-3-(3-quinolyl)-DL-Ala-OH is C17H20N2O4.

What is the molecular weight of Boc-3-(3-quinolyl)-DL-Ala-OH?

The molecular weight of Boc-3-(3-quinolyl)-DL-Ala-OH is 316.1423 g/mol.

Where can I buy Boc-3-(3-quinolyl)-DL-Ala-OH?

You can request a quote for Boc-3-(3-quinolyl)-DL-Ala-OH directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Boc-3-(3-quinolyl)-DL-Ala-OH?

Yes, CoreyChem provides custom synthesis services for Boc-3-(3-quinolyl)-DL-Ala-OH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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