| Formula |
C25H24N4O3S |
| IUPAC Name |
4-methoxy-n-phenyl-3-[3-(1h-pyrrolo[2,3-b]pyridin-5-ylmethylsulfanyl)propanoylamino]benzamide |
| Molecular Mass |
460.548 g·mol−1 |
| Heat of Formation |
-101.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.30 ± 1.08 D |
| Volume |
534.39 Å 3 |
| Surface Area |
489.64 Å 2 |
| HOMO Energy |
-8.63 ± 0.55 eV |
| LUMO Energy |
-0.74 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
NNMDRKWRQGOYCR-UHFFFAOYSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
S
O
N
|
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