N-{4-[(4Ar,10Bs)-8,9-Dimethoxy-2-Methyl-1,2,3,4,4A,10B-Hexahydrobenzo[C][1,6]Naphthyridin-6-Yl]Phenyl}-4-Methylbenzenesulfonamide

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Properties Simple | Detailed

Formula C28H31N3O4S
IUPAC Name n-[4-[(4ar,10bs)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1h-benzo[c][1,6]naphthyridin-6-yl]phenyl]-4-methyl-benzenesulfonamide
Molecular Mass 505.628 g·mol−1
Heat of Formation -310.9 ± 16.7 kJ·mol−1
Dipole Moment 6.63 ± 1.08 D
Volume 600.6 Å 3
Surface Area 467.07 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 2.46 ± eV
Point Group Symmetry C1
Synonyms
  • n-[4-[(4ar,10bs)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1h-pyrido[4,3-c]isoquinolin-6-yl]phenyl]-4-methyl-benzenesulfonamide
  • n-[4-[(4ar,10bs)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1h-pyrido[4,3-c]isoquinolin-6-yl]phenyl]-4-methylbenzenesulfonamide
InChIKey FVZJIAUYFDQQKJ-JWQCQUIFSA-N
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