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3-benzoylsulfanyl-2-[(2-nitrophenyl)sulfanylamino]propanoic acid;N-cyclohexylcyclohexanamine

3-benzoylsulfanyl-2-[(2-nitrophenyl)sulfanylamino]propanoic acid;N-cyclohexylcyclohexanamine structure

CAS No:
2596-03-4
Formula:
C28H37N3O5S2
Chemical Name:
3-benzoylsulfanyl-2-[(2-nitrophenyl)sulfanylamino]propanoic acid;N-cyclohexylcyclohexanamine
Synonyms:
2596-03-4;NSC154950;DTXSID80302897;NSC-154950;S-Benzoyl-N-[(2-nitrophenyl)sulfanyl]cysteine--N-cyclohexylcyclohexanamine (1/1)

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3-benzoylsulfanyl-2-[(2-nitrophenyl)sulfanylamino]propanoic acid;N-cyclohexylcyclohexanamine Basic Attributes

Molecular Weight：

559.7 g/mol

Exact Mass：

559.21746364 g/mol

NSC Number：

154950

DSSTox ID：

DTXSID80302897

Characteristics

PSA：

175 Å²

Computed Properties

Molecular Weight:559.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:10
Exact Mass:559.21746364
Monoisotopic Mass:559.21746364
Topological Polar Surface Area:175
Heavy Atom Count:38
Complexity:596
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 3-benzoylsulfanyl-2-[(2-nitrophenyl)sulfanylamino]propanoic acid;N-cyclohexylcyclohexanamine

Basic Attributes
Characteristics
Computed Properties

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