Formula |
C23H29N5O2S |
IUPAC Name |
1-cyclohexyl-n-[6-(4-hydroxy-1-piperidyl)-3-pyridyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide |
Molecular Mass |
439.574 g·mol−1 |
Heat of Formation |
-39.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.66 ± 1.08 D |
Volume |
516.45 Å 3 |
Surface Area |
457.95 Å 2 |
HOMO Energy |
-8.21 ± 0.55 eV |
LUMO Energy |
-1.04 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
NFWMSIMJLJHZPQ-UHFFFAOYSA-N |
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Links |
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Elements |
H
S
C
O
N
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