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Home Other Building Blocks 1-Hexyl-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione

1-Hexyl-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione

CAS No.:
1028-33-7
Catalog Number:
AG003EKA
Molecular Formula:
C13H20N4O2
Molecular Weight:
264.3235
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Product Description
Catalog Number:
AG003EKA
Chemical Name:
1-Hexyl-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione
CAS Number:
1028-33-7
Molecular Formula:
C13H20N4O2
Molecular Weight:
264.3235
MDL Number:
MFCD00041424
IUPAC Name:
1-hexyl-3,7-dimethylpurine-2,6-dione
InChI:
InChI=1S/C13H20N4O2/c1-4-5-6-7-8-17-12(18)10-11(14-9-15(10)2)16(3)13(17)19/h9H,4-8H2,1-3H3
InChI Key:
MRWQRJMESRRJJB-UHFFFAOYSA-N
SMILES:
CCCCCCn1c(=O)c2n(C)cnc2n(c1=O)C
EC Number:
213-842-0
UNII:
MBM1C4K26S
Properties
Complexity:
361  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.159g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.329g/mol
Monoisotopic Mass:
264.159g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Non-human primate SPECT model for determining cerebral perfusion effects of cerebrovasoactive drugs acting via multiple modes of pharmacological action. Journal of the neurological sciences 20050315
Pentoxifylline, propentofylline and pentifylline for acute ischaemic stroke. The Cochrane database of systematic reviews 20040101
Glucan stimulates human dermal fibroblast collagen biosynthesis through a nuclear factor-1 dependent mechanism. Wound repair and regeneration : official publication of the Wound Healing Society [and] the European Tissue Repair Society 20020101
Properties