2-[(2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoyl]-2-azabicyclo[2.1.1]hexane-1-carboxamide
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![2-[(2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoyl]-2-azabicyclo[2.1.1]hexane-1-carboxamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/76275d3cf3b543dcbe7347ec3059e541.png "2-[(2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoyl]-2-azabicyclo[2.1.1]hexane-1-carboxamide")
2-[(2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoyl]-2-azabicyclo[2.1.1]hexane-1-carboxamide
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CAS No:
127902-57-2
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Formula:
C17H22N6O4
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Chemical Name:
2-[(2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoyl]-2-azabicyclo[2.1.1]hexane-1-carboxamide
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Synonyms:
2-carboxy-2,4-methanopyrrolidine-TRH;3-(2,4-MePro)-thyrotropin-releasing hormone;3-(2,4-MePro)-TRH;thyrotropin-releasing hormone, 2,4-MePro(3)-;thyrotropin-releasing hormone, 2,4-methylproline(3)-;TRH, (2,4-methanoproline)(3)-;127902-57-2;3-(2,4-Mepro)-trh;Thyrotropin-releasing hormone, 2,4-mepro(3)-;TRH, (2,4-methanoproline)(3)-;2-Carboxy-2,4-methanopyrrolidine-trh;3-(2,4-Mepro)-thyrotropin-releasing hormone;Thyrotropin-releasing hormone, 2,4-methylproline(3)-;DTXSID00926019;2-{N-[Hydroxy(5-hydroxy-3,4-dihydro-2H-pyrrol-2-yl)methylidene]histidyl}-2-azabicyclo[2.1.1]hexane-1-carboximidic acid
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CAS No:
2-[(2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoyl]-2-azabicyclo[2.1.1]hexane-1-carboxamide Basic Attributes
374.4 g/mol
374.17025320 g/mol
Computed Properties
Molecular Weight:374.4
XLogP3:-2.6
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:374.17025320
Monoisotopic Mass:374.17025320
Topological Polar Surface Area:150
Heavy Atom Count:27
Complexity:676
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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