CHEMBRDG-BB 4023079

CAT: 0926-FC156727Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0926-FC156727Size:250 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

15371-15-0

Smiles

CN1C2=C (N=C1Br) N (C (=O) NC2=O) C

Molecular Formula

C7H7BrN4O2

Molecular Weight

259.06 g/mol

Controlled

Chemical Information

8-Bromo-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione

CAS Number	15371-15-0
PubChem CID	702242
IUPAC Name	8-bromo-3,7-dimethylpurine-2,6-dione
Molecular Formula	C7H7BrN4O2
Molecular Weight	259.06
XLogP	0.2
Topological Polar Surface Area	67.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	14
Formal Charge	0
Complexity	297

SMILES

CN1C2=C(N=C1Br)N(C(=O)NC2=O)C

InChI

InChI=1S/C7H7BrN4O2/c1-11-3-4(9-6(11)8)12(2)7(14)10-5(3)13/h1-2H3,(H,10,13,14)

InChIKey

BFCGRDZSZWDOMD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 15371-15-0

CID: 702242

Formula: C7H7BrN4O2

MW: 259.06

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	259.06
XLogP3	0.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	257.97524
Monoisotopic Mass	257.97524
Topological Polar Surface Area	67.2 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	297
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

Catalog	Name
M22252-01	CHEMBRDG-BB 7118966
OR1027096-01	Chembrdg-Bb 7265027
C2240-01	CHEMBRDG-BB 7959525
T7279-01	CHEMBRDG-BB 4024832
MBS4380803-01	Creatine Phosphokinase-BB (CK-BB)
QY-E05656	Human Bb COMPONENT FACTOR (BB)
MBS439874-01	Creatine Kinase-BB (CK-BB)
167941	PDGF-BB, Recombinant, Human, (Human PDGF-BB, h-PDGF-BB, PDGFBB, PDGF BB, PDGF-BB, rh-PDGF-BB, recombinant human PDGF-BB, recombinant PDGF-BB, PDGF) discontinued
167940-01	PDGF-BB, Active, Recombinant, Mouse (Murine PDGF-BB, m-PDGF-BB, PDGFBB, PDGF-BB, PDGF BB, rm-PDGF-BB, recombinant murine PDGF-BB, recombinant PDGF-BB, PDGF) discontinued
N2168-20	Soyasaponin BB