4-methyl-N-[(2S)-3-methyl-1-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-1-oxobutan-2-yl]benzamide
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![4-methyl-N-[(2S)-3-methyl-1-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-1-oxobutan-2-yl]benzamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/468f1b13c435456e87b90ca5d39f4db7.png "4-methyl-N-[(2S)-3-methyl-1-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-1-oxobutan-2-yl]benzamide")
4-methyl-N-[(2S)-3-methyl-1-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-1-oxobutan-2-yl]benzamide
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CAS No:
957012-82-7
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Formula:
C27H27N3O2S
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Chemical Name:
4-methyl-N-[(2S)-3-methyl-1-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-1-oxobutan-2-yl]benzamide
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Synonyms:
ZINC2626528;AKOS034827409;MCULE-7120638444;Z57016671;(2S)-3-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(4-methylphenyl)formamido]butanamide;957012-82-7
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CAS No:
4-methyl-N-[(2S)-3-methyl-1-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-1-oxobutan-2-yl]benzamide Basic Attributes
457.6 g/mol
457.18239829 g/mol
Computed Properties
Molecular Weight:457.6
XLogP3:6.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:457.18239829
Monoisotopic Mass:457.18239829
Topological Polar Surface Area:99.3
Heavy Atom Count:33
Complexity:670
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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