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3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one structure
Fine Chemical

3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

TL;DR: 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one (CAS 498538-52-6) is a chemical compound with molecular formula C23H21N5O3 and molecular weight 415.16443 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

13-(4-ethoxyphenyl)-17-(2-methoxyethyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one

Also Known As: 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one, 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one

CAS Number
498538-52-6
Molecular Formula
C23H21N5O3
Molecular Weight
415.16443 g/mol
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Technical Specifications

Molecular FormulaC23H21N5O3
Molecular Weight415.16443 g/mol
XLogP2.7
Topological Polar Surface Area (TPSA)81.8 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors6
Rotatable Bonds6
Exact Mass415.16443 Da
Heavy Atoms31
Complexity668.0
SMILESCCOC1=CC=C(C=C1)N2C=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3CCOC
InChIKeyKXYOUWOUAZGJDR-UHFFFAOYSA-N

Product Description

Applications: AC1LZYWX is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies AC1LZYWX (CAS 498538-52-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A fine chemical supplied by CoreyChem, AC1LZYWX (CAS 498538-52-6) has the molecular formula C23H21N5O3 and a molecular weight of 415.16 g/mol. It is also known as 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one and 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one.

CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

XLogP
2.7
TPSA (Topological Polar Surface Area)
81.8
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
6
Rotatable Bonds
6
Heavy Atoms
31
Complexity
668.0
Exact Mass
415.16443
Monoisotopic Mass
415.16443
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 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one. Following Lipinski's Rule of Five, 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one?

The CAS number of 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one is 498538-52-6.

What is the molecular formula of 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one?

The molecular formula of 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one is C23H21N5O3.

What is the molecular weight of 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one?

The molecular weight of 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one is 415.16443 g/mol.

What are the applications of 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one?

AC1LZYWX is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies AC1LZYWX (CAS 498538-52-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Where can I buy 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one?

You can request a quote for 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one?

Yes, CoreyChem provides custom synthesis services for 3-(4-ethoxyphenyl)-11-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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