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methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate structure
Fine Chemical

methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate

TL;DR: methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate (CAS 1173681-26-9) is a chemical compound with molecular formula C19H19N3O4 and molecular weight 353.13754 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

methyl (2S)-2-[(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]-3-phenylpropanoate

Also Known As: (S)-methyl 2-(3-oxo-1,2,3,4-tetrahydroquinoxaline-1-carboxamido)-3-phenylpropanoate, methyl (2S)-2-[(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]-3-phenylpropanoate, methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate

CAS Number
1173681-26-9
Molecular Formula
C19H19N3O4
Molecular Weight
353.13754 g/mol
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Technical Specifications

Molecular FormulaC19H19N3O4
Molecular Weight353.13754 g/mol
XLogP2.0
Topological Polar Surface Area (TPSA)87.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds5
Exact Mass353.13754 Da
Heavy Atoms26
Complexity533.0
SMILESCOC(=O)[C@H](CC1=CC=CC=C1)NC(=O)N2CC(=O)NC3=CC=CC=C32
InChIKeyKIBYFFQMQDVZEB-HNNXBMFYSA-N

Chemical Property Profile of methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate

XLogP
2.0
TPSA (Topological Polar Surface Area)
87.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
5
Heavy Atoms
26
Complexity
533.0
Exact Mass
353.13754
Monoisotopic Mass
353.13754
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 methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate

The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate. Following Lipinski's Rule of Five, methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate?

The CAS number of methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate is 1173681-26-9.

What is the molecular formula of methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate?

The molecular formula of methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate is C19H19N3O4.

What is the molecular weight of methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate?

The molecular weight of methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate is 353.13754 g/mol.

Where can I buy methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate?

You can request a quote for methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate?

Yes, CoreyChem provides custom synthesis services for methyl N-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-phenylalaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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