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Luciferase-IN-4 structure
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Luciferase-IN-4

TL;DR: Luciferase-IN-4 (CAS 1020413-85-7) is a chemical compound with molecular formula C14H11ClN2O and molecular weight 258.056 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(Z)-1-(4-chlorophenyl)-3-(pyridin-2-ylamino)prop-2-en-1-one

Also Known As: Luciferase-IN-4, EX-A14074, AB00088432-01, (Z)-1-(4-chlorophenyl)-3-(pyridin-2-ylamino)prop-2-en-1-one, CID 5310655

CAS Number
1020413-85-7
Molecular Formula
C14H11ClN2O
Molecular Weight
258.056 g/mol
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Technical Specifications

Molecular FormulaC14H11ClN2O
Molecular Weight258.056 g/mol
XLogP3.8
Topological Polar Surface Area (TPSA)42.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds4
Exact Mass258.056 Da
Heavy Atoms18
Complexity298.0
SMILESC1=CC=NC(=C1)N/C=C\C(=O)C2=CC=C(C=C2)Cl
InChIKeyWXXHFZLFNUHSEB-NTMALXAHSA-N

Chemical Property Profile of Luciferase-IN-4

XLogP
3.8
TPSA (Topological Polar Surface Area)
42.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
4
Heavy Atoms
18
Complexity
298.0
Exact Mass
258.056
Monoisotopic Mass
258.056
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 Luciferase-IN-4

The XLogP value of 3.8 indicates that Luciferase-IN-4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, Luciferase-IN-4 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Luciferase-IN-4 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Luciferase-IN-4?

The CAS number of Luciferase-IN-4 is 1020413-85-7.

What is the molecular formula of Luciferase-IN-4?

The molecular formula of Luciferase-IN-4 is C14H11ClN2O.

What is the molecular weight of Luciferase-IN-4?

The molecular weight of Luciferase-IN-4 is 258.056 g/mol.

Where can I buy Luciferase-IN-4?

You can request a quote for Luciferase-IN-4 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Luciferase-IN-4?

Yes, CoreyChem provides custom synthesis services for Luciferase-IN-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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