JY-3-094

CAT: 0804-HY-125978-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-125978-01Size:5 mg

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Description

JY-3-094 is a Myc inhibitor that inhibits Myc-Max heterodimer formation (IC50: 33 μM) [1].

CAS Number

389076-27-1

UNSPSC

12352005

Target

C-Myc

Type

Reference compound

Related Pathways

Apoptosis

Applications

Cancer-programmed cell death

Field of Research

Cancer

Assay Protocol

https://www.medchemexpress.com/jy-3-094.html

Purity

97.04

Solubility

DMSO : 25 mg/mL (ultrasonic)

Smiles

O=C(O)C1=CC=C(NC2=CC=C([N+]([O-])=O)C3=NON=C32)C=C1

Molecular Formula

C13H8N4O5

Molecular Weight

300.23

References & Citations

[1]Yap JL, et al. Pharmacophore identification of c-Myc inhibitor 10074-G5. Bioorg Med Chem Lett. 2013 Jan 1;23 (1) :370-4.

Shipping Conditions

Room Temperature

Storage Conditions

-20°C, 3 years; 4°C, 2 years (Powder)

Scientific Category

Reference compound1

Clinical Information

No Development Reported

Chemical Information

4-(7-Nitro-benzo[1,2,5]oxadiazol-4-ylamino)-benzoic acid

CAS Number	389076-27-1
PubChem CID	2836606
IUPAC Name	4-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]benzoic acid
Molecular Formula	C13H8N4O5
Molecular Weight	300.23
XLogP	2.1
Topological Polar Surface Area	134
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	3
Heavy Atom Count	22
Formal Charge	0
Complexity	435

SMILES

C1=CC(=CC=C1C(=O)O)NC2=CC=C(C3=NON=C23)[N+](=O)[O-]

InChI

InChI=1S/C13H8N4O5/c18-13(19)7-1-3-8(4-2-7)14-9-5-6-10(17(20)21)12-11(9)15-22-16-12/h1-6,14H,(H,18,19)

InChIKey

ZEIZFLAEFWOEKQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 389076-27-1

CID: 2836606

Formula: C13H8N4O5

MW: 300.23

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	300.23
XLogP3	2.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	3
Exact Mass	300.04946937
Monoisotopic Mass	300.04946937
Topological Polar Surface Area	134 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	435
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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