(4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate
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![(4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/1474b38335814c109d82210ed6cf6078.png "(4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate")
(4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate
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CAS No:
956159-21-0
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Formula:
C27H30ClNO6
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Chemical Name:
(4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate
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Synonyms:
ZINC2094174;AKOS030497498;(S)-4-butyl-6-chloro-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-phenylpropanoate;956159-21-0
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CAS No:
(4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate Basic Attributes
500.0 g/mol
499.1761654 g/mol
Computed Properties
Molecular Weight:500.0
XLogP3:6.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:11
Exact Mass:499.1761654
Monoisotopic Mass:499.1761654
Topological Polar Surface Area:90.9
Heavy Atom Count:35
Complexity:785
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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