(αS)-N-[3-[[4-[(3-Aminopropyl)amino]butyl]amino]propyl]-4-hydroxy-α-[(1-oxobutyl)amino]benzenepropanamide
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![(αS)-N-[3-[[4-[(3-Aminopropyl)amino]butyl]amino]propyl]-4-hydroxy-α-[(1-oxobutyl)amino]benzenepropanamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d876a3cc5a5b4968873616b960804f56.png "(αS)-N-[3-[[4-[(3-Aminopropyl)amino]butyl]amino]propyl]-4-hydroxy-α-[(1-oxobutyl)amino]benzenepropanamide")
(αS)-N-[3-[[4-[(3-Aminopropyl)amino]butyl]amino]propyl]-4-hydroxy-α-[(1-oxobutyl)amino]benzenepropanamide
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CAS No:
115976-93-7
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Formula:
C23H41N5O3
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Chemical Name:
(αS)-N-[3-[[4-[(3-Aminopropyl)amino]butyl]amino]propyl]-4-hydroxy-α-[(1-oxobutyl)amino]benzenepropanamide
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Synonyms:
Benzenepropanamide,N-[3-[[4-[(3-aminopropyl)amino]butyl]amino]propyl]-4-hydroxy-α-[(1-oxobutyl)amino]-,(αS)-;Benzenepropanamide,N-[3-[[4-[(3-aminopropyl)amino]butyl]amino]propyl]-4-hydroxy-α-[(1-oxobutyl)amino]-,(S)-;(αS)-N-[3-[[4-[(3-Aminopropyl)amino]butyl]amino]propyl]-4-hydroxy-α-[(1-oxobutyl)amino]benzenepropanamide;PTX 343;Philanthotoxin 343;PhTX 343;(S)-PTX 343;(S)-Philanthotoxin 343;(S)-PhTX 343
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CAS No:
(αS)-N-[3-[[4-[(3-Aminopropyl)amino]butyl]amino]propyl]-4-hydroxy-α-[(1-oxobutyl)amino]benzenepropanamide Basic Attributes
435.6 g/mol
435.60
Computed Properties
Molecular Weight:435.6
XLogP3:1
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:18
Exact Mass:435.32094019
Monoisotopic Mass:435.32094019
Topological Polar Surface Area:129
Heavy Atom Count:31
Complexity:470
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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