Products for Research Use Only

HUHS015

CAT: 0013-GTR19171391-03Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19171391-03Size:1 ml x 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
HUHS015
CAS Number
1453097-13-6
Product Name Alternative
ALKBH3, antigen-1, cancer, HUHS 015, HUHS015, HUHS-015, Inhibitor, PCA-1, PCA-1/ALKBH3, inhibit, prostate
Field of Research
Immunology & Inflammation
Purity
99.33% (May vary between batches)
Solubility
10% DMSO+90% Corn Oil:2.5 mg/mL (7.85 mM) ; DMSO:50 mg/mL (157.05 mM)
Smiles
Cc1nn (c (O) c1Cc1ccccc1) -c1nc2ccc (C) cc2[nH]1
Molecular Formula
C19H18N4O
Molecular Weight
318.37
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Huhs015
CAS Number1453097-13-6
PubChem CID71696702
IUPAC Name4-benzyl-5-methyl-2-(6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-3-one
Molecular FormulaC19H18N4O
Molecular Weight318.4
XLogP4
Topological Polar Surface Area61
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count24
Formal Charge0
Complexity525
SMILES
CC1=CC2=C(C=C1)N=C(N2)N3C(=O)C(=C(N3)C)CC4=CC=CC=C4
InChI
InChI=1S/C19H18N4O/c1-12-8-9-16-17(10-12)21-19(20-16)23-18(24)15(13(2)22-23)11-14-6-4-3-5-7-14/h3-10,22H,11H2,1-2H3,(H,20,21)
InChIKey
IQOKQFQFGHZHJT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Huhs015
CAS: 1453097-13-6
CID: 71696702
Formula: C19H18N4O
MW: 318.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight318.4
XLogP34
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass318.14806121
Monoisotopic Mass318.14806121
Topological Polar Surface Area61 Ų
Heavy Atom Count24
Formal Charge0
Complexity525
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