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RefChem:1074205 structure
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RefChem:1074205

TL;DR: RefChem:1074205 (CAS 116990-03-5) is a chemical compound with molecular formula C25H20ClN5O2 and molecular weight 457.13055 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(9-chloroindolo[3,2-b]quinoxalin-6-yl)-N-[(E)-1-(4-methoxyphenyl)ethylideneamino]acetamide

Also Known As: 9-Chloro-6H-indolo(2,3-b)quinoxaline-6-acetic acid (1-(4-methoxyphenyl)ethylidene)hydrazide, 6H-Indolo(2,3-b)quinoxaline-6-acetic acid, 9-chloro-, (1-(4-methoxyphenyl)ethylidene)hydrazide

CAS Number
116990-03-5
Molecular Formula
C25H20ClN5O2
Molecular Weight
457.13055 g/mol
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Technical Specifications

Molecular FormulaC25H20ClN5O2
Molecular Weight457.13055 g/mol
XLogP4.7
Topological Polar Surface Area (TPSA)81.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds5
Exact Mass457.13055 Da
Heavy Atoms33
Complexity728.0
SMILESC/C(=N\NC(=O)CN1C2=C(C=C(C=C2)Cl)C3=NC4=CC=CC=C4N=C31)/C5=CC=C(C=C5)OC
InChIKeyAAMBXVGMRPRMGU-WKULSOCRSA-N

Chemical Property Profile of RefChem:1074205

XLogP
4.7
TPSA (Topological Polar Surface Area)
81.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
5
Heavy Atoms
33
Complexity
728.0
Exact Mass
457.13055
Monoisotopic Mass
457.13055
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 RefChem:1074205

The XLogP value of 4.7 indicates that RefChem:1074205 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1074205. Following Lipinski's Rule of Five, RefChem:1074205 has 1 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 RefChem:1074205?

The CAS number of RefChem:1074205 is 116990-03-5.

What is the molecular formula of RefChem:1074205?

The molecular formula of RefChem:1074205 is C25H20ClN5O2.

What is the molecular weight of RefChem:1074205?

The molecular weight of RefChem:1074205 is 457.13055 g/mol.

Where can I buy RefChem:1074205?

You can request a quote for RefChem:1074205 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:1074205?

Yes, CoreyChem provides custom synthesis services for RefChem:1074205 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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