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methyl (2S)-2-[(2,3-dimethylphenyl)carbamoylamino]-4-methylsulfanylbutanoate

methyl (2S)-2-[(2,3-dimethylphenyl)carbamoylamino]-4-methylsulfanylbutanoate structure

CAS No:
958983-57-8
Formula:
C15H22N2O3S
Chemical Name:
methyl (2S)-2-[(2,3-dimethylphenyl)carbamoylamino]-4-methylsulfanylbutanoate
Synonyms:
MLS000560023;SMR000439407;(R)-2-[3-(2,3-Dimethyl-phenyl)-ureido]-4-methylsulfanyl-butyric acid methyl ester;CHEMBL1330828;BDBM72662;cid_2010837;HMS2812H10;ZINC2413593;AKOS032387900;methyl (2S)-2-[(2,3-dimethylphenyl)carbamoylamino]-4-methylsulfanylbutanoate;MCULE-5352084485;(2S)-2-[(2,3-dimethylphenyl)carbamoylamino]-4-(methylthio)butyric acid methyl ester;(2S)-2-[[(2,3-dimethylanilino)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester;methyl (2S)-2-[(2,3-dimethylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate;958983-57-8

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methyl (2S)-2-[(2,3-dimethylphenyl)carbamoylamino]-4-methylsulfanylbutanoate Basic Attributes

Molecular Weight：

310.4 g/mol

Exact Mass：

310.13511374 g/mol

Characteristics

PSA：

92.7 Å²

Water Solubility：

37.1 [ug/mL]

Computed Properties

Molecular Weight:310.4
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:310.13511374
Monoisotopic Mass:310.13511374
Topological Polar Surface Area:92.7
Heavy Atom Count:21
Complexity:352
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of methyl (2S)-2-[(2,3-dimethylphenyl)carbamoylamino]-4-methylsulfanylbutanoate

Basic Attributes
Characteristics
Computed Properties
Learn More Other Chemicals

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