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
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Synonyms
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- [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
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InChIKey |
ZWXFJUPNUWRODU-UHFFFAOYSA-N |
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Links |
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Elements |
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