(2-{4-[2-(1-Pyrrolidinyl)Ethoxy]Phenyl}-1-Benzothiophen-3-Yl){6-[2-(1-Pyrrolidinyl)Ethoxy]-3-Pyridinyl}Methanone

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Properties Simple | Detailed

Formula C32H35N3O3S
IUPAC Name [2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzothiophen-3-yl]-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridyl]methanone
Molecular Mass 541.704 g·mol−1
Heat of Formation -127.1 ± 16.7 kJ·mol−1
Dipole Moment 4.24 ± 1.08 D
Volume 664.21 Å 3
Surface Area 523.7 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -1.18 ± eV
Point Group Symmetry C1
Synonyms
  • [2-[4-(2-1-pyrrolidinylethoxy)phenyl]-3-benzothiophenyl]-[6-(2-1-pyrrolidinylethoxy)-3-pyridyl]methanone
  • [2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]-[6-(2-pyrrolidin-1-ylethoxy)pyridin-3-yl]methanone
  • bt1
  • {2-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl]-benzo[b]thiophen-3-yl}-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl]-methanone
InChIKey ZWXFJUPNUWRODU-UHFFFAOYSA-N
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