Name: Name:6H-Purin-6-one, 1,2,3,7,8,9-hexahydro-2,8-dithioxo-
Brand: Angene
SKU: AG001RH7
Rating: 90 (10 reviews)

6H-Purin-6-one, 1,2,3,7,8,9-hexahydro-2,8-dithioxo-

CAS No.:

15986-32-0

Catalog Number:

AG001RH7

Molecular Formula:

C5H4N4OS2

Molecular Weight:

200.2415

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Purity

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Price(USD)

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Product Description

Catalog Number:

AG001RH7

Chemical Name:

6H-Purin-6-one, 1,2,3,7,8,9-hexahydro-2,8-dithioxo-

CAS Number:

15986-32-0

Molecular Formula:

C5H4N4OS2

Molecular Weight:

200.2415

MDL Number:

MFCD00047144

IUPAC Name:

2,8-bis(sulfanylidene)-7,9-dihydro-3H-purin-6-one

InChI:

InChI=1S/C5H4N4OS2/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h(H4,6,7,8,9,10,11,12)

InChI Key:

NDSUZZIWNBVBKW-UHFFFAOYSA-N

SMILES:

S=c1[nH]c2c([nH]1)[nH]c(=S)[nH]c2=O

EC Number:

240-120-2

UNII:

D7JFZ7X71T

Properties

Complexity:

334

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

199.983g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

200.234g/mol

Monoisotopic Mass:

199.983g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

129A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.7

Literature

Title	Journal
Effect of an anti-thyroid drug, 2,8-Dimercapto-6-hydroxy purine on reproduction in male rats.	Pakistan journal of pharmaceutical sciences 20120401
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
A synthetic uric acid analog accelerates cutaneous wound healing in mice.	PloS one 20100101

Properties