Formula |
C26H35N7O2S |
IUPAC Name |
n-tert-butyl-3-[[5-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]benzenesulfonamide |
Molecular Mass |
509.667 g·mol−1 |
Heat of Formation |
-53.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.43 ± 1.08 D |
Volume |
610.08 Å 3 |
Surface Area |
459.79 Å 2 |
HOMO Energy |
-7.81 ± 0.55 eV |
LUMO Energy |
-0.54 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- n-tert-butyl-3-[[5-methyl-2-[[4-(4-methyl-1-piperazinyl)phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide
- n-tert-butyl-3-[[5-methyl-2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]pyrimidin-4-yl]amino]benzenesulfonamide
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InChIKey |
JVDOKQYTTYUYDV-UHFFFAOYSA-N |
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Links |
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Elements |
H
S
C
O
N
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