(3S)-4-[[(2S)-1-[(2S)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]pyrrolidine-2-carbonyl]amino]-4-oxo-3-(2-propylpentanoylamino)butanoic acid
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![(3S)-4-[[(2S)-1-[(2S)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]pyrrolidine-2-carbonyl]amino]-4-oxo-3-(2-propylpentanoylamino)butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/88b6845016714389aa8f48a55720e6f3.png "(3S)-4-[[(2S)-1-[(2S)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]pyrrolidine-2-carbonyl]amino]-4-oxo-3-(2-propylpentanoylamino)butanoic acid")
(3S)-4-[[(2S)-1-[(2S)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]pyrrolidine-2-carbonyl]amino]-4-oxo-3-(2-propylpentanoylamino)butanoic acid
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CAS No:
151275-15-9
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Formula:
C23H40N6O6
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Chemical Name:
(3S)-4-[[(2S)-1-[(2S)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]pyrrolidine-2-carbonyl]amino]-4-oxo-3-(2-propylpentanoylamino)butanoic acid
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Synonyms:
CVS 738;CVS-738;Cvs 738;DTXSID70164749;L-Prolinamide, N-(1-oxo-2-propylpentyl)-L-alpha-aspartyl-N-(4-((aminoiminomethyl)amino)-1-formylbutyl)-, (S)-
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CAS No:
(3S)-4-[[(2S)-1-[(2S)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]pyrrolidine-2-carbonyl]amino]-4-oxo-3-(2-propylpentanoylamino)butanoic acid Basic Attributes
496.6 g/mol
496.30093302 g/mol
Computed Properties
Molecular Weight:496.6
XLogP3:-1.9
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:16
Exact Mass:496.30093302
Monoisotopic Mass:496.30093302
Topological Polar Surface Area:197
Heavy Atom Count:35
Complexity:764
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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