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methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate structure
Fine Chemical

methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate

TL;DR: methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate (CAS 1042700-76-4) is a chemical compound with molecular formula C30H30N2O8 and molecular weight 546.2002 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

methyl 2-[2-[3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxochromen-7-yl]oxyacetyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate

Also Known As: methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate, methyl 2-({[3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl]oxy}acetyl)-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate, methyl 2-[2-[3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxochromen-7-yl]oxyacetyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate

CAS Number
1042700-76-4
Molecular Formula
C30H30N2O8
Molecular Weight
546.2002 g/mol
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Technical Specifications

Molecular FormulaC30H30N2O8
Molecular Weight546.2002 g/mol
XLogP3.4
Topological Polar Surface Area (TPSA)124.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors8
Rotatable Bonds10
Exact Mass546.2002 Da
Heavy Atoms40
Complexity1030.0
SMILESCCOC(=O)CCC1=C(C2=C(C=C(C=C2)OCC(=O)N3CC4=C(CC3C(=O)OC)C5=CC=CC=C5N4)OC1=O)C
InChIKeyOMXCSPXQMJAXPS-UHFFFAOYSA-N

Chemical Property Profile of methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate

XLogP
3.4
TPSA (Topological Polar Surface Area)
124.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
8
Rotatable Bonds
10
Heavy Atoms
40
Complexity
1030.0
Exact Mass
546.2002
Monoisotopic Mass
546.2002
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 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate

The XLogP value of 3.4 indicates that methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate. Following Lipinski's Rule of Five, methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate?

The CAS number of methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate is 1042700-76-4.

What is the molecular formula of methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate?

The molecular formula of methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate is C30H30N2O8.

What is the molecular weight of methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate?

The molecular weight of methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate is 546.2002 g/mol.

Where can I buy methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate?

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Does CoreyChem offer custom synthesis for methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate?

Yes, CoreyChem provides custom synthesis services for methyl 2-(2-((3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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