Lapisteride

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Formula C29H40N2O3
IUPAC Name (1s,3as,3bs,5ar,9ar,9bs,11as)-n-[1-(4-methoxyphenyl)-1-methyl-ethyl]-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide
Molecular Mass 464.640 g·mol−1
Heat of Formation -559.1 ± 16.7 kJ·mol−1
Dipole Moment 4.73 ± 1.08 D
Volume 593.38 Å 3
Surface Area 459.14 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy 0.01 ± eV
Point Group Symmetry C1
Synonyms
  • (1s,3as,3bs,5ar,9ar,9bs,11as)-7-keto-n-[1-(4-methoxyphenyl)-1-methyl-ethyl]-9a,11a-dimethyl-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide
  • (1s,3as,3bs,5ar,9ar,9bs,11as)-n-[1-(4-methoxyphenyl)-1-methyl-ethyl]-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide
  • (1s,3as,3bs,5ar,9ar,9bs,11as)-n-[1-(4-methoxyphenyl)-1-methylethyl]-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide
  • (1s,3as,3bs,5ar,9ar,9bs,11as)-n-[2-(4-methoxyphenyl)propan-2-yl]-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide
InChIKey NAGKTIAFDQEFJI-DPMIIFTQSA-N
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