methyl (2R)-2-[4-(1,3-benzothiazol-2-yl)butanoylamino]-3-(1H-indol-3-yl)propanoate
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methyl (2R)-2-[4-(1,3-benzothiazol-2-yl)butanoylamino]-3-(1H-indol-3-yl)propanoate
structure -
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CAS No:
956239-73-9
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Formula:
C23H23N3O3S
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Chemical Name:
methyl (2R)-2-[4-(1,3-benzothiazol-2-yl)butanoylamino]-3-(1H-indol-3-yl)propanoate
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Synonyms:
ZINC3333842;AKOS034827803;MCULE-2411719306;Z57050987;methyl (2R)-2-[4-(1,3-benzothiazol-2-yl)butanamido]-3-(1H-indol-3-yl)propanoate;956239-73-9
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CAS No:
methyl (2R)-2-[4-(1,3-benzothiazol-2-yl)butanoylamino]-3-(1H-indol-3-yl)propanoate Basic Attributes
421.5 g/mol
421.14601278 g/mol
Computed Properties
Molecular Weight:421.5
XLogP3:4.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:421.14601278
Monoisotopic Mass:421.14601278
Topological Polar Surface Area:112
Heavy Atom Count:30
Complexity:604
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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