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5-Aminothiazolo[4,5-d]pyrimidine-2,7(3H,6H)-dione

5-Aminothiazolo[4,5-d]pyrimidine-2,7(3H,6H)-dione - CAS 30161-97-8

Catalog:	BB020473
Product Name:	5-Aminothiazolo[4,5-d]pyrimidine-2,7(3H,6H)-dione
CAS:	30161-97-8
Synonyms:	5-amino-3,6-dihydrothiazolo[4,5-d]pyrimidine-2,7-dione; 5-amino-3,6-dihydro-[1,3]thiazolo[4,5-d]pyrimidine-2,7-dione

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	5-amino-3,6-dihydro-[1,3]thiazolo[4,5-d]pyrimidine-2,7-dione
Description:	5-Aminothiazolo[4,5-d]pyrimidine-2,7(3H,6H)-dione (CAS# 30161-97-8) is a useful research chemical.
Molecular Weight:	184.18
Molecular Formula:	C5H4N4O2S
Canonical SMILES:	C12=C(NC(=O)S1)N=C(NC2=O)N
InChI:	InChI=1S/C5H4N4O2S/c6-4-7-2-1(3(10)9-4)12-5(11)8-2/h(H4,6,7,8,9,10,11)
InChI Key:	YDWRPBIUDIYAOX-UHFFFAOYSA-N
MDL:	MFCD09839926
LogP:	-0.16370

Publication Number	Title	Priority Date
CN-110938104-A	Cyclic dinucleotide analogs, pharmaceutical compositions and uses thereof	20180921
WO-2020057546-A1	Cyclic dinucleotide analogue, pharmaceutical composition thereof, and application	20180921
TW-202023572-A	Cyclic dinucleotide analogue, its pharmaceutical composition and application	20180921
EP-3854799-A1	Cyclic dinucleotide analogue, pharmaceutical composition thereof, and application	20180921
KR-20210062668-A	Cyclic dinucleotide analogues, pharmaceutical compositions and uses thereof	20180921

PMID	Publication Date	Title	Journal
18385852	20080421	2'-Deoxyimmunosine: stereoselective synthesis, base pairing and duplex stability of oligonucleotides containing 8-oxo-7-thiaguanine	Organic & biomolecular chemistry
9875377	19980101	Thiazolo[4,5-d]pyrimidines. Part II. Synthesis and anti-human cytomegalovirus activity in vitro of certain acyclonucleosides and acyclonucleotides derived from the guanine analogue 5-aminothiazolo[4,5-d]pyrimidine-2,7(3H,6H)-dione	Antiviral chemistry & chemotherapy

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Complexity:	345
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	184.00549656
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	184.00549656
Rotatable Bond Count:	0
Topological Polar Surface Area:	122
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1.1