(6-chloro-4-ethyl-2-oxochromen-7-yl) (2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
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![(6-chloro-4-ethyl-2-oxochromen-7-yl) (2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a1b616f7974a449ea29597bd692e7249.png "(6-chloro-4-ethyl-2-oxochromen-7-yl) (2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate")
(6-chloro-4-ethyl-2-oxochromen-7-yl) (2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
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CAS No:
956045-30-0
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Formula:
C21H26ClNO6
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Chemical Name:
(6-chloro-4-ethyl-2-oxochromen-7-yl) (2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
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Synonyms:
ZINC2095776;AKOS030497869;(S)-6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate;956045-30-0
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CAS No:
(6-chloro-4-ethyl-2-oxochromen-7-yl) (2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Basic Attributes
423.9 g/mol
423.1448652 g/mol
Computed Properties
Molecular Weight:423.9
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:423.1448652
Monoisotopic Mass:423.1448652
Topological Polar Surface Area:90.9
Heavy Atom Count:29
Complexity:669
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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