(1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane

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Names

[ CAS No. ]:
423165-07-5

[ Name ]:
(1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane

[Synonym ]:
(3-exo)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane
(1R,5S)-3-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane
8-Azabicyclo[3.2.1]octane, 3-[3-methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-, (3-exo)

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
402.4±55.0 °C at 760 mmHg

[ Melting Point ]:
117ºC

[ Molecular Formula ]:
C13H22N4

[ Molecular Weight ]:
234.341

[ Flash Point ]:
197.1±31.5 °C

[ Exact Mass ]:
234.184448

[ PSA ]:
42.74000

[ LogP ]:
1.14

[ Vapour Pressure ]:
0.0±0.9 mmHg at 25°C

[ Index of Refraction ]:
1.678

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 8-benzyl-3-exo-(3-isopropyl-5-methyl-4h-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane
  • N-Benzylnortropinone Oxime
  • 3-Oxopentanedioic acid
  • N-Benzyltropinone
  • Benzyl-8-azabicyclo[3.2.1]octan-3-exo-amine
  • N-((1R,3s,5S)-8-Benzyl-8-azabicyclo[3.2.1]octan-3-yl)isobutyramide

DownStream

  • ((S)-3-[3-(3-ISOPROPYL-5-METHYL-[1,2,4]TRIAZOL-4-YL)-8-AZA-BICYCLO[3.2.1]OCT-8-YL]-1-PHENYL-PROPYL)-CARBAMIC ACID TERT-BUTYL ESTER
  • Maraviroc

Related Compounds

  • 2-(4-ethoxyphenoxy)-N-((1-(4-ethoxyphenyl)-1H-tetrazol-5-yl)methyl)acetamide
  • N-((1-(4-ethoxyphenyl)-1H-tetrazol-5-yl)methyl)-2-(p-tolyloxy)acetamide
  • N-((1-(4-ethoxyphenyl)-1H-tetrazol-5-yl)methyl)-2-(2-fluorophenoxy)acetamide
  • N-((1-(4-ethoxyphenyl)-1H-tetrazol-5-yl)methyl)-2-(4-fluorophenoxy)acetamide
  • N-((1-(4-ethoxyphenyl)-1H-tetrazol-5-yl)methyl)-2-phenylacetamide
  • N-((1-(4-ethoxyphenyl)-1H-tetrazol-5-yl)methyl)-2-(4-fluorophenyl)acetamide
  • 2-(4-chlorophenyl)-N-((1-(4-ethoxyphenyl)-1H-tetrazol-5-yl)methyl)acetamide
  • N-((1-(4-ethoxyphenyl)-1H-tetrazol-5-yl)methyl)-2-(naphthalen-1-yl)acetamide
  • N-((1-(4-ethoxyphenyl)-1H-tetrazol-5-yl)methyl)-2,2-diphenylacetamide
  • Ethyl 2-[(4-methylphenyl)sulfonyl]-3,3-bis(methylthio)-2-propenoate
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