N-[(2R,4S,5S,7R)-4-Amino-8-(Butylamino)-5-Hydroxy-2,7-Dimethyl-8-Oxooctyl]-2-(3-Methoxypropoxy)Benzamide

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Properties Simple | Detailed

Formula C25H43N3O5
IUPAC Name n-[(2r,4s,5s,7r)-4-amino-8-(butylamino)-5-hydroxy-2,7-dimethyl-8-oxo-octyl]-2-(3-methoxypropoxy)benzamide
Molecular Mass 465.626 g·mol−1
Heat of Formation -1085.3 ± 16.7 kJ·mol−1
Dipole Moment 3.66 ± 1.08 D
Volume 612.8 Å 3
Surface Area 490.76 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy -0.42 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(2r,4s,5s,7r)-4-amino-8-butylamino-5-hydroxy-2,7-dimethyl-8-oxo-octyl]-2-(3-methoxypropoxy)benzamide
  • n-[(2r,4s,5s,7r)-4-amino-8-butylamino-5-hydroxy-2,7-dimethyl-8-oxooctyl]-2-(3-methoxypropoxy)benzamide
  • n-[(2r,4s,5s,7r)-4-amino-8-butylamino-5-hydroxy-8-keto-2,7-dimethyl-octyl]-2-(3-methoxypropoxy)benzamide
InChIKey HCEVFKSMFFEYMG-WKDRNLAYSA-N
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