Formula |
C34H34ClN7O3 |
IUPAC Name |
4-[[1-[3-(2-carbamoylphenyl)-5-chloro-phenyl]-3-methyl-pyrazolo[4,3-c]pyridin-6-yl]amino]-3-methoxy-n-(1-methyl-4-piperidyl)benzamide |
Molecular Mass |
624.132 g·mol−1 |
Heat of Formation |
17.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.42 ± 1.08 D |
Volume |
726.14 Å 3 |
Surface Area |
625.53 Å 2 |
HOMO Energy |
-8.36 ± 0.55 eV |
LUMO Energy |
2.04 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
CQZVQAYBJDSPFL-UHFFFAOYSA-N |
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Elements |
H
C
Cl
O
N
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