Ethyl {(2R)-1-[(2S)-2-{[2-(4-Aminobutyl)Hydrazino]Carbonyl}-1-Pyrrolidinyl]-1-Oxo-3-Phenyl-2-Propanyl}Carbamate

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Properties Simple | Detailed

Formula C21H33N5O4
IUPAC Name ethyl n-[(1r)-2-[(2s)-2-[(4-aminobutylamino)carbamoyl]pyrrolidin-1-yl]-1-benzyl-2-oxo-ethyl]carbamate
Molecular Mass 419.518 g·mol−1
Heat of Formation -653.7 ± 16.7 kJ·mol−1
Dipole Moment 3.01 ± 1.08 D
Volume 538.05 Å 3
Surface Area 444.16 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy 0.14 ± eV
Point Group Symmetry C1
Synonyms
  • 1-ethoxycarbonyl-d-phe-pro-2(4-aminobutyl)hydrazine
  • ethyl n-[(1r)-2-[(2s)-2-[(4-aminobutylamino)carbamoyl]pyrrolidin-1-yl]-2-oxo-1-(phenylmethyl)ethyl]carbamate
  • ethyl n-[(2r)-1-[(2s)-2-[(4-aminobutylamino)carbamoyl]pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamate
  • n-[(1r)-2-[(2s)-2-[(n'-(4-aminobutyl)hydrazino)-oxomethyl]-1-pyrrolidinyl]-2-oxo-1-(phenylmethyl)ethyl]carbamic acid ethyl ester
InChIKey AEHSFPPTWRQOFS-MSOLQXFVSA-N
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