(Z)-6-[(1S,2S,3R,4S)-2-[[(4-bromophenyl)sulfonylamino]methyl]-3-bicyclo[2.2.1]heptanyl]hex-5-enoic acid
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![(Z)-6-[(1S,2S,3R,4S)-2-[[(4-bromophenyl)sulfonylamino]methyl]-3-bicyclo[2.2.1]heptanyl]hex-5-enoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/2a24529a082b499084009241c21954bc.png "(Z)-6-[(1S,2S,3R,4S)-2-[[(4-bromophenyl)sulfonylamino]methyl]-3-bicyclo[2.2.1]heptanyl]hex-5-enoic acid")
(Z)-6-[(1S,2S,3R,4S)-2-[[(4-bromophenyl)sulfonylamino]methyl]-3-bicyclo[2.2.1]heptanyl]hex-5-enoic acid
structure -
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CAS No:
130466-54-5
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Formula:
C20H26BrNO4S
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Chemical Name:
(Z)-6-[(1S,2S,3R,4S)-2-[[(4-bromophenyl)sulfonylamino]methyl]-3-bicyclo[2.2.1]heptanyl]hex-5-enoic acid
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Synonyms:
Ono-NT 126;
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CAS No:
(Z)-6-[(1S,2S,3R,4S)-2-[[(4-bromophenyl)sulfonylamino]methyl]-3-bicyclo[2.2.1]heptanyl]hex-5-enoic acid Basic Attributes
456.39400
455.07659
Drug Information
6-(3-((((4-bromophenyl)sulfonyl)amino)methyl)bicyclo(2.2.1)hept-2-yl)-hex-5-enoic acid
Computed Properties
Molecular Weight:456.4
XLogP3:4.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:455.07659
Monoisotopic Mass:455.07659
Topological Polar Surface Area:91.8
Heavy Atom Count:27
Complexity:637
Defined Atom Stereocenter Count:4
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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