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Epiblastin A 10mg

CAT: 0628-A22121-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0628-A22121-10Size:10 mg
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CAS Number
16470-02-3

Chemical Information

6-(3-Chlorophenyl)pteridine-2,4,7-Triamine
CAS Number16470-02-3
PubChem CID118987042
IUPAC Name6-(3-chlorophenyl)pteridine-2,4,7-triamine
Molecular FormulaC12H10ClN7
Molecular Weight287.71
XLogP1.6
Topological Polar Surface Area130
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity344
SMILES
C1=CC(=CC(=C1)Cl)C2=NC3=C(N=C(N=C3N=C2N)N)N
InChI
InChI=1S/C12H10ClN7/c13-6-3-1-2-5(4-6)7-9(14)18-11-8(17-7)10(15)19-12(16)20-11/h1-4H,(H6,14,15,16,18,19,20)
InChIKey
ZWNKKZSRANLVEW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-(3-Chlorophenyl)pteridine-2,4,7-Triamine
CAS: 16470-02-3
CID: 118987042
Formula: C12H10ClN7
MW: 287.71
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight287.71
XLogP31.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count1
Exact Mass287.0686210
Monoisotopic Mass287.0686210
Topological Polar Surface Area130 Ų
Heavy Atom Count20
Formal Charge0
Complexity344
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