1-[(4-Nitrophenyl)methyl] (2S,4S)-2-[[(3-carboxyphenyl)amino]carbonyl]-4-mercapto-1-pyrrolidinecarboxylate

1-[(4-Nitrophenyl)methyl] (2S,4S)-2-[[(3-carboxyphenyl)amino]carbonyl]-4-mercapto-1-pyrrolidinecarboxylate

Cat. No.: PI202467694

1-[(4-Nitrophenyl)methyl] (2S,4S)-2-[[(3-carboxyphenyl)amino]carbonyl]-4-mercapto-1-pyrrolidinecarboxylate
Product Details Computed Properties
CAS 202467-69-4
Synonyms 1-Pyrrolidinecarboxylic acid,2-[[(3-carboxyphenyl)amino]carbonyl]-4-mercapto-,1-[(4-nitrophenyl)methyl] ester,(2S-cis)-
Molecular Formula C20H19N3O7S
Molecular Weight 445.45
Density 1.5±0.1 g/cm3
Boiling Point 749.6 °C at 760 mmHg
Flash Point 407.1±32.9 °C
Refractive Index 1.676
Complexity 693
Compound Is Canonicalized Yes
Covalently-Bonded Unit Count 1
Defined Atom Stereocenter Count 2
Exact Mass 445.09437113
Heavy Atom Count 31
Hydrogen Bond Acceptor Count 8
Hydrogen Bond Donor Count 3
Monoisotopic Mass 445.09437113
Rotatable Bond Count 6
XLogP3 2.4

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