3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane 4-methylbenzenesulfonate

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Names

[ CAS No. ]:
423165-08-6

[ Name ]:
3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane 4-methylbenzenesulfonate

[Synonym ]:
4-methylbenzenesulfonic acid,3-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane

Chemical & Physical Properties

[ Boiling Point ]:
402.4ºC at 760 mmHg

[ Molecular Formula ]:
C20H30N4O3S

[ Molecular Weight ]:
406.54200

[ Flash Point ]:
197.1ºC

[ Exact Mass ]:
406.20400

[ PSA ]:
105.49000

[ LogP ]:
4.81670

Safety Information

[ HS Code ]:
2933990090

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
  • p-Toluenesulfonic acid
  • N-Benzylnortropinone Oxime
  • tert-butyl (3-exo-8-benzyl-8-azabicyclo[3.2.1]oct-3-yl)carbamate
  • 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
  • N-Benzyltropinone

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

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%