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5437-25-2 | 1H-Purine-2,6(3H,9H)-dithione
CAS No: 5437-25-2 Catalog No: AG003B5S MDL No:MFCD00022644
Product Description
Catalog Number:
AG003B5S
Chemical Name:
1H-Purine-2,6(3H,9H)-dithione
CAS Number:
5437-25-2
Molecular Formula:
C5H4N4S2
Molecular Weight:
184.2421
MDL Number:
MFCD00022644
IUPAC Name:
3,7-dihydropurine-2,6-dithione
InChI:
InChI=1S/C5H4N4S2/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11)
InChI Key:
VQPMXSMUUILNFZ-UHFFFAOYSA-N
SMILES:
S=c1[nH]c(=S)c2c([nH]1)[nH]cn2
EC Number:
226-608-8
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.988g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
184.235g/mol
Monoisotopic Mass:
183.988g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| 2,6-Dithiopurine, a nucleophilic scavenger, protects against mutagenesis in mouse skin treated in vivo with 2-(chloroethyl) ethyl sulfide, a mustard gas analog. | Toxicology and applied pharmacology 20120901 |
| Cell signalling by reactive lipid species: new concepts and molecular mechanisms. | The Biochemical journal 20120315 |
| Protection against 2-chloroethyl ethyl sulfide (CEES)-induced cytotoxicity in human keratinocytes by an inducer of the glutathione detoxification pathway. | Toxicology and applied pharmacology 20110901 |
| 2,6-Dithiopurine blocks toxicity and mutagenesis in human skin cells exposed to sulfur mustard analogues, 2-chloroethyl ethyl sulfide and 2-chloroethyl methyl sulfide. | Chemical research in toxicology 20100315 |
| Acacia Senegal gum exudate offers protection against cyclophosphamide-induced urinary bladder cytotoxicity. | Oxidative medicine and cellular longevity 20090101 |
| Mixed effects of 2,6-dithiopurine against cyclophosphamide mediated bladder and lung toxicity in mice. | Toxicology 19980116 |
| Structure-activity relationships for the binding of ligands to xanthine or guanine phosphoribosyl-transferase from Toxoplasma gondii. | Biochemical pharmacology 19951109 |
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