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RefChem:1072025 structure
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RefChem:1072025

TL;DR: RefChem:1072025 (CAS 126245-03-2) is a chemical compound with molecular formula C23H15N5O5 and molecular weight 441.10733 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(5Z)-5-[(4-nitrophenyl)methylidene]-3-[(E)-(4-nitrophenyl)methylideneamino]-2-phenylimidazol-4-one

Also Known As: 4-(p-Nitrobenzylidene)-1-((p-nitrobenzylidene)amino)-2-phenyl-2-imidazolin-5-one, 4H-Imidazol-4-one, 3,5-dihydro-5-((4-nitrophenyl)methylene)-3-(((4-nitrophenyl)methylene)amino)-2-phenyl-, 2-Imidazolin-5-one, 4-(p-nitrobenzylidene)-1-((p-nitrobenzylidene)amino)-2-phenyl-

CAS Number
126245-03-2
Molecular Formula
C23H15N5O5
Molecular Weight
441.10733 g/mol
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Technical Specifications

Molecular FormulaC23H15N5O5
Molecular Weight441.10733 g/mol
XLogP4.5
Topological Polar Surface Area (TPSA)137.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors7
Rotatable Bonds4
Exact Mass441.10733 Da
Heavy Atoms33
Complexity836.0
SMILESC1=CC=C(C=C1)C2=N/C(=C\C3=CC=C(C=C3)[N+](=O)[O-])/C(=O)N2/N=C/C4=CC=C(C=C4)[N+](=O)[O-]
InChIKeyZXNBZIHIXANWLF-GYTCFKOFSA-N

Chemical Property Profile of RefChem:1072025

XLogP
4.5
TPSA (Topological Polar Surface Area)
137.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
7
Rotatable Bonds
4
Heavy Atoms
33
Complexity
836.0
Exact Mass
441.10733
Monoisotopic Mass
441.10733
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:1072025

The XLogP value of 4.5 indicates that RefChem:1072025 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1072025. Following Lipinski's Rule of Five, RefChem:1072025 has 0 hydrogen bond donor(s) and 7 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:1072025?

The CAS number of RefChem:1072025 is 126245-03-2.

What is the molecular formula of RefChem:1072025?

The molecular formula of RefChem:1072025 is C23H15N5O5.

What is the molecular weight of RefChem:1072025?

The molecular weight of RefChem:1072025 is 441.10733 g/mol.

Where can I buy RefChem:1072025?

You can request a quote for RefChem:1072025 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:1072025?

Yes, CoreyChem provides custom synthesis services for RefChem:1072025 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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