Formula |
C23H25ClN6O3 |
IUPAC Name |
[2-[[5-chloro-2-(2-methoxy-4-morpholino-anilino)pyrimidine-1,3-diium-5-id-4-yl]amino]benzene-5-ide-1-carbonyl]-methyl-azanide |
Molecular Mass |
468.936 g·mol−1 |
Heat of Formation |
-150.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.53 ± 1.08 D |
Volume |
541.21 Å 3 |
Surface Area |
437.72 Å 2 |
HOMO Energy |
-8.36 ± 0.55 eV |
LUMO Energy |
2.32 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[[5-chloro-2-[(2-methoxy-4-morpholin-4-yl-phenyl)amino]pyrimidin-4-yl]amino]-n-methyl-benzamide
- 2-[[5-chloro-2-[(2-methoxy-4-morpholin-4-ylphenyl)amino]pyrimidin-4-yl]amino]-n-methylbenzamide
- 2-[[5-chloro-2-[(2-methoxy-4-morpholino-phenyl)amino]pyrimidin-4-yl]amino]-n-methyl-benzamide
- 2-[[5-chloro-2-[(2-methoxy-4-morpholinophenyl)amino]-4-pyrimidinyl]amino]-n-methylbenzamide
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InChIKey |
UYJNQQDJUOUFQJ-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
N
O
Cl
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