Formula |
C23H30N4O3S |
IUPAC Name |
8-[3-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]propoxy]-8-azaspiro[4.5]decane-7,9-dione |
Molecular Mass |
442.574 g·mol−1 |
Heat of Formation |
-203.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.62 ± 1.08 D |
Volume |
528.15 Å 3 |
Surface Area |
456.19 Å 2 |
HOMO Energy |
-8.19 ± 0.55 eV |
LUMO Energy |
-0.54 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 8-[3-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]propoxy]-8-azaspiro[4.5]decane-7,9-dione
- 8-[3-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]propoxy]-8-azaspiro[4.5]decane-7,9-quinone
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InChIKey |
RJSZSZMMKYSISN-UHFFFAOYSA-N |
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Links |
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Elements |
H
S
C
O
N
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