1,3-benzothiazol-2-ylmethyl (2S)-2-[(2-chlorobenzoyl)amino]-3-methylbutanoate
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1,3-benzothiazol-2-ylmethyl (2S)-2-[(2-chlorobenzoyl)amino]-3-methylbutanoate
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CAS No:
956713-97-6
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Formula:
C20H19ClN2O3S
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Chemical Name:
1,3-benzothiazol-2-ylmethyl (2S)-2-[(2-chlorobenzoyl)amino]-3-methylbutanoate
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Synonyms:
ZINC2643542;AKOS034826937;MCULE-2548090280;Z56980375;(1,3-benzothiazol-2-yl)methyl (2S)-2-[(2-chlorophenyl)formamido]-3-methylbutanoate;956713-97-6
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CAS No:
1,3-benzothiazol-2-ylmethyl (2S)-2-[(2-chlorobenzoyl)amino]-3-methylbutanoate Basic Attributes
402.9 g/mol
402.0804913 g/mol
Computed Properties
Molecular Weight:402.9
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:402.0804913
Monoisotopic Mass:402.0804913
Topological Polar Surface Area:96.5
Heavy Atom Count:27
Complexity:533
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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