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ethyl3-[cyclohexyl-[(2,2-dimethyl-3H-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-amino]propanoate

ethyl3-[cyclohexyl-[(2,2-dimethyl-3H-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-amino]propanoate structure

CAS No:
82560-67-6
Formula:
C23H34N2O5S
Chemical Name:
ethyl3-[cyclohexyl-[(2,2-dimethyl-3H-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-amino]propanoate
Synonyms:
beta-Alanine, N-cyclohexyl-N-(((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)thio)-, ethyl ester;SCHEMBL10483398;CTK5E9817;DTXSID70231864;ethyl 3-[cyclohexyl-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanylamino]propanoate;LS-15992;b-Alanine,N-cyclohexyl-N-[[[[(2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy]carbonyl]methylamino]thio]-,ethyl ester

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ethyl3-[cyclohexyl-[(2,2-dimethyl-3H-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-amino]propanoate Basic Attributes

Molecular Weight：

450.594

Exact Mass：

450.219

DSSTox ID：

DTXSID70231864

Characteristics

PSA：

93.6

XLogP3：

5.2

Computed Properties

Molecular Weight:450.6
XLogP3:5.2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:450.21884336
Monoisotopic Mass:450.21884336
Topological Polar Surface Area:93.6
Heavy Atom Count:31
Complexity:611
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl3-[cyclohexyl-[(2,2-dimethyl-3H-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-amino]propanoate

Basic Attributes
Characteristics
Computed Properties

ethyl3-[cyclohexyl-[(2,2-dimethyl-3H-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-amino]propanoate

SDS

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