Products for Research Use Only

LY2955303

CAT: 0013-GTR19174321-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19174321-02Size:5 mg
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Description
LY2955303
CAS Number
1433497-19-8
Product Name Alternative
Autophagy, inhibit, LY2955303, LY-2955303, LY 2955303, Inhibitor, RAR/RXR, RARγ, Retinoid Receptor, Retinoid X receptors, Retinoic acid receptors, RetinoidReceptor
Field of Research
Cell Biology, Metabolism Research
Purity
98.56% (May vary between batches)
Solubility
DMSO:25 mg/mL (43.2 mM)
Smiles
CN1CCN (CC1) C (=O) c1ccc (cc1) -n1nc (cc1-c1cc (cc (c1) C (C) (C) C) C (C) (C) C) -c1ccc (cc1) C (O) =O
Molecular Formula
C36H42N4O3
Molecular Weight
578.74
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

LY-2955303

structure in first source

CAS Number1433497-19-8
PubChem CID71552369
IUPAC Name4-[5-(3,5-ditert-butylphenyl)-1-[4-(4-methylpiperazine-1-carbonyl)phenyl]pyrazol-3-yl]benzoic acid
Molecular FormulaC36H42N4O3
Molecular Weight578.7
XLogP5.1
Topological Polar Surface Area78.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count43
Formal Charge0
Complexity927
SMILES
CC(C)(C)C1=CC(=CC(=C1)C2=CC(=NN2C3=CC=C(C=C3)C(=O)N4CCN(CC4)C)C5=CC=C(C=C5)C(=O)O)C(C)(C)C
InChI
InChI=1S/C36H42N4O3/c1-35(2,3)28-20-27(21-29(22-28)36(4,5)6)32-23-31(24-8-10-26(11-9-24)34(42)43)37-40(32)30-14-12-25(13-15-30)33(41)39-18-16-38(7)17-19-39/h8-15,20-23H,16-19H2,1-7H3,(H,42,43)
InChIKey
YVXYHNKIOFSFMZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of LY-2955303
CAS: 1433497-19-8
CID: 71552369
Formula: C36H42N4O3
MW: 578.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight578.7
XLogP35.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass578.32569121
Monoisotopic Mass578.32569121
Topological Polar Surface Area78.7 Ų
Heavy Atom Count43
Formal Charge0
Complexity927
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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