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RefChem:1078903 structure
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RefChem:1078903

TL;DR: RefChem:1078903 (CAS 132785-11-6) is a chemical compound with molecular formula C28H19N5O4 and molecular weight 489.1437 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[(E)-[4-[2-(2-nitrophenyl)-4-oxoquinazolin-3-yl]phenyl]methylideneamino]benzamide

Also Known As: Benzoic acid, ((4-(2-(2-nitrophenyl)-4-oxo-3(4H)-quinazolinyl)phenyl)methylene)hydrazide

CAS Number
132785-11-6
Molecular Formula
C28H19N5O4
Molecular Weight
489.1437 g/mol
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Technical Specifications

Molecular FormulaC28H19N5O4
Molecular Weight489.1437 g/mol
XLogP4.8
Topological Polar Surface Area (TPSA)120.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds5
Exact Mass489.1437 Da
Heavy Atoms37
Complexity901.0
SMILESC1=CC=C(C=C1)C(=O)N/N=C/C2=CC=C(C=C2)N3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C5[N+](=O)[O-]
InChIKeyJUVKSFSAQWLNJV-RDRPBHBLSA-N

Chemical Property Profile of RefChem:1078903

XLogP
4.8
TPSA (Topological Polar Surface Area)
120.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
5
Heavy Atoms
37
Complexity
901.0
Exact Mass
489.1437
Monoisotopic Mass
489.1437
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:1078903

The XLogP value of 4.8 indicates that RefChem:1078903 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1078903. Following Lipinski's Rule of Five, RefChem:1078903 has 1 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 RefChem:1078903?

The CAS number of RefChem:1078903 is 132785-11-6.

What is the molecular formula of RefChem:1078903?

The molecular formula of RefChem:1078903 is C28H19N5O4.

What is the molecular weight of RefChem:1078903?

The molecular weight of RefChem:1078903 is 489.1437 g/mol.

Where can I buy RefChem:1078903?

You can request a quote for RefChem:1078903 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:1078903?

Yes, CoreyChem provides custom synthesis services for RefChem:1078903 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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