N~2~-[(Benzyloxy)Carbonyl]-N-[(2S,3S)-3-Hydroxy-1-(4-Hydroxyphenyl)-2-Butanyl]-L-Leucinamidato

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Properties Simple | Detailed

Formula C24H32N2O5
IUPAC Name benzyl n-[(1s)-1-[[(1s,2s)-2-hydroxy-1-[(4-hydroxyphenyl)methyl]propyl]carbamoyl]-3-methyl-butyl]carbamate
Molecular Mass 428.521 g·mol−1
Heat of Formation -915.0 ± 16.7 kJ·mol−1
Dipole Moment 3.16 ± 1.08 D
Volume 536.96 Å 3
Surface Area 417.69 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy -0.30 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(1s)-1-[[(1s,2s)-2-hydroxy-1-(4-hydroxybenzyl)propyl]carbamoyl]-3-methyl-butyl]carbamic acid benzyl ester
  • n-[(1s)-1-[[[(1s,2s)-2-hydroxy-1-[(4-hydroxyphenyl)methyl]propyl]amino]-oxomethyl]-3-methylbutyl]carbamic acid phenylmethyl ester
  • n~2~-[(benzyloxy)carbonyl]-n-[(1s,2s)-2-hydroxy-1-(4-hydroxybenzyl)propyl]-l-leucinamide
  • phenylmethyl n-[(1s)-1-[[(1s,2s)-2-hydroxy-1-[(4-hydroxyphenyl)methyl]propyl]carbamoyl]-3-methyl-butyl]carbamate
  • phenylmethyl n-[(2s)-1-[[(2s,3s)-3-hydroxy-1-(4-hydroxyphenyl)butan-2-yl]amino]-4-methyl-1-oxo-pentan-2-yl]carbamate
  • phenylmethyl n-[(2s)-1-[[(2s,3s)-3-hydroxy-1-(4-hydroxyphenyl)butan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate
InChIKey ZUWYQZGBCBSHFK-HSQYWUDLSA-N
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