[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine

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Names

[ CAS No. ]:
2829-57-4

[ Name ]:
[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine

[Synonym ]:
7-Amino<1,2,5>thiadiazolo<3,4-d>pyrimidin
6-Amino-8-thiapurine

Chemical & Physical Properties

[ Density]:
1.736g/cm3

[ Boiling Point ]:
340.6ºC at 760 mmHg

[ Molecular Formula ]:
C4H3N5S

[ Molecular Weight ]:
153.16500

[ Flash Point ]:
159.8ºC

[ Exact Mass ]:
153.01100

[ PSA ]:
105.82000

[ LogP ]:
0.64470

[ Vapour Pressure ]:
8.53E-05mmHg at 25°C

[ Index of Refraction ]:
1.84

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XI4820000
CHEMICAL NAME :
(1,2,5)Thiadiazolo(3,4-d)pyrimidin-7-amine
CAS REGISTRY NUMBER :
2829-57-4
BEILSTEIN REFERENCE NO. :
0131778
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C4-H3-N5-S

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
455 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
KHFZAN Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1967- Volume(issue)/page/year: 11(2),82,1977

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 4,5,6-Triaminopyrimidine
  • 2-Chloro-6-fluorobenzyl chloride

DownStream

  • 1,2,5-Thiadiazole-3-carboximidamide,4-amino-N-ethyl-
  • [1,2,5]Thiadiazolo[3,4-d]pyrimidin-7-amine,N-butyl-
  • 1,2,5-Thiadiazole-3-carboximidamide,4-amino-N-butyl-
  • [1,2,5]Thiadiazolo[3,4-d]pyrimidine,7-(1-pyrrolidinyl)-
  • N-benzyl-8-thia-2,4,7,9-tetrazabicyclo[4.3.0]nona-2,4,6,9-tetraen-5-amine
  • [1,2,5]Thiadiazolo[3,4-d]pyrimidin-7-amine,N-ethyl-
  • N-cyclohexyl-8-thia-2,4,7,9-tetrazabicyclo[4.3.0]nona-2,4,6,9-tetraen-5-amine
  • N,N-dimethyl-8-thia-2,4,7,9-tetrazabicyclo[4.3.0]nona-2,4,6,9-tetraen-5-amine
  • [1,2,5]Thiadiazolo[3,4-d]pyrimidin-7-amine, N-phenyl-
  • [1,2,5]Thiadiazolo[3,4-d]pyrimidine,7-(4-morpholinyl)-

Related Compounds

  • 5-methyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
  • n-benzyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
  • N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
  • 5-methyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
  • n-benzyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
  • N-phenyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
  • (2S)-3-(1,3-dioxolan-2-yl)-2-{[(prop-2-en-1-yloxy)carbonyl]amino}propanoic acid
  • rac-(4R,5S)-4,5-dihydroxy-1-[(prop-2-en-1-yloxy)carbonyl]piperidine-2-carboxylic acid
  • rac-(3R,4S)-3,4-dihydroxy-1-[(prop-2-en-1-yloxy)carbonyl]piperidine-2-carboxylic acid
  • rac-2-{[(3R,4S)-4-hydroxyoxolan-3-yl][(prop-2-en-1-yloxy)carbonyl]amino}acetic acid
  • rac-(2R,3R,4S)-3,4-dihydroxy-1-[(prop-2-en-1-yloxy)carbonyl]piperidine-2-carboxylic acid
  • 4-Acetamido-1,2-thiazole-3-carboxylic acid
  • ethyl (2S)-2-amino-5-azidopentanoate
  • 1-{1,4-Dioxa-9-azaspiro[5.5]undecan-2-yl}methanamine
  • 5-Acetamido-1,3,4-thiadiazole-2-carboxylic acid
  • 1-Acetyl-4-hydroxypiperidine-3-carboxylic acid
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