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NPD7155

CAT: 0931-T28192-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T28192-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
924764-38-5
Target
Others, Endogenous Metabolite
Related Pathways
Others, Metabolism
Bioactivity
NPD7155 is a competitive inhibitor of MTH1.
Smiles
CC12CN(C(C1)CC(C)(C)C2)C3=C4C(=NC=N3)N=CN4
Molecular Formula
C15H21N5
Molecular Weight
271.36
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

6-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-9H-purine
CAS Number924764-38-5
PubChem CID16407622
IUPAC Name6-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)-7H-purine
Molecular FormulaC15H21N5
Molecular Weight271.36
XLogP3.1
Topological Polar Surface Area57.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity398
SMILES
CC1(CC2CC(C1)(CN2C3=NC=NC4=C3NC=N4)C)C
InChI
InChI=1S/C15H21N5/c1-14(2)4-10-5-15(3,6-14)7-20(10)13-11-12(17-8-16-11)18-9-19-13/h8-10H,4-7H2,1-3H3,(H,16,17,18,19)
InChIKey
JWPIQIKLBJGZHZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-9H-purine
CAS: 924764-38-5
CID: 16407622
Formula: C15H21N5
MW: 271.36
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight271.36
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass271.17969569
Monoisotopic Mass271.17969569
Topological Polar Surface Area57.7 Ų
Heavy Atom Count20
Formal Charge0
Complexity398
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-111094NPD7155

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