methyl (2S)-2-[(3-chloro-4-fluorophenyl)carbamoylamino]-4-methylsulfanylbutanoate
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methyl (2S)-2-[(3-chloro-4-fluorophenyl)carbamoylamino]-4-methylsulfanylbutanoate
structure -
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CAS No:
1173686-79-7
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Formula:
C13H16ClFN2O3S
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Chemical Name:
methyl (2S)-2-[(3-chloro-4-fluorophenyl)carbamoylamino]-4-methylsulfanylbutanoate
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Synonyms:
C13H16ClFN2O3S;ZINC2434858;AKOS032390268;MCULE-6865710960;1173686-79-7
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CAS No:
methyl (2S)-2-[(3-chloro-4-fluorophenyl)carbamoylamino]-4-methylsulfanylbutanoate Basic Attributes
334.79 g/mol
334.0554194 g/mol
Computed Properties
Molecular Weight:334.79
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:334.0554194
Monoisotopic Mass:334.0554194
Topological Polar Surface Area:92.7
Heavy Atom Count:21
Complexity:362
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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