(2S,6R)-6-Amino-2-(2-thienyl)-1,4-thiazepan-5-one

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Names

[ CAS No. ]:
110221-26-6

[ Name ]:
(2S,6R)-6-Amino-2-(2-thienyl)-1,4-thiazepan-5-one

[Synonym ]:
BH006
1,4-Thiazepin-5(2H)-one, 6-aminotetrahydro-2-(2-thienyl)-, (2S,6R)-
(2S,6R)-6-Amino-5-oxo-2-(2-thienyl)perhydro-1,4-thiazepine
(2S,6R)-6-Amino-2-(2-thienyl)-1,4-thiazepan-5-one
(2S,6R)-6-Amino-2-(thiophen-2-yl)-1,4-thiazepan-5-on
6-Amino-2-thiophen-2-yl-[1,4]thiazepan-5-one
(2S,6R)-6-Amino-2-(thiophen-2-yl)-1,4-thiazepan-5-one

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
492.8±45.0 °C at 760 mmHg

[ Melting Point ]:
163-165ºC

[ Molecular Formula ]:
C9H12N2OS2

[ Molecular Weight ]:
228.334

[ Flash Point ]:
251.8±28.7 °C

[ Exact Mass ]:
228.039108

[ PSA ]:
108.66000

[ LogP ]:
0.00

[ Vapour Pressure ]:
0.0±1.3 mmHg at 25°C

[ Index of Refraction ]:
1.605

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2-[(E)-2-Nitrovinyl]thiophene
  • N-t-butoxycarbonyl-S-[2-nitro-1-(thien-2-yl)ethyl]-L-cysteine

DownStream

  • Temocapril (hydrochloride)
  • (S)-ETHYL 2-(((2S,6R)-5-OXO-2-(THIOPHEN-2-YL)-1,4-THIAZEPAN-6-YL)AMINO)-4-PHENYLBUTANOATE
  • Temocaprilat

Related Compounds

  • (2R,6R)-6-AMINO-5-OXO-2-(2-THIENYL)PERHYDRO-1,4-THIAZEPINE
  • (6R)-6-amino-1,4-thiazepan-5-one
  • tert-Butyl (2S,6R)-6-amino-5-oxo-2-(2-thienyl)perhydro-1,4-thiazepine-4-acetate
  • (R)-6-AMINO-1,4-THIAZEPAN-5-ONE
  • TERTBUTYL-6-AMINO-5-OXO-2(2-THIENYL)PERHYDRO-1,4-THIAZEPINE-4-ACETATE
  • (2R,6R)-2-(thiophen-2-yl)-6-(tritylamino)-1,4-thiazepan-5-one