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3-methyl-N-[(2S)-3-methyl-1-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]benzamide

3-methyl-N-[(2S)-3-methyl-1-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]benzamide structure

CAS No:
956049-00-6
Formula:
C21H23N3O4S2
Chemical Name:
3-methyl-N-[(2S)-3-methyl-1-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]benzamide
Synonyms:
MLS001010637;CHEMBL1304245;HMS2736L19;ZINC2617809;AKOS034827229;MCULE-7173188060;SMR000352858;AB00611092-02;Z56999255;(2S)-N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)-3-methyl-2-[(3-methylphenyl)formamido]butanamide;956049-00-6

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3-methyl-N-[(2S)-3-methyl-1-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]benzamide Basic Attributes

Molecular Weight：

445.6 g/mol

Exact Mass：

445.11299857 g/mol

Characteristics

PSA：

142 Å²

Computed Properties

Molecular Weight:445.6
XLogP3:3.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:445.11299857
Monoisotopic Mass:445.11299857
Topological Polar Surface Area:142
Heavy Atom Count:30
Complexity:737
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-methyl-N-[(2S)-3-methyl-1-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]benzamide

Basic Attributes
Characteristics
Computed Properties

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