Formula |
C32H42N6O3 |
IUPAC Name |
2-[[6-[[2-(3-hydroxypropyl)-5-methyl-anilino]methyl]-2-(3-morpholinopropylamino)benzimidazol-1-yl]methyl]-6-methyl-pyridin-3-ol |
Molecular Mass |
558.714 g·mol−1 |
Heat of Formation |
-253.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.56 ± 1.08 D |
Volume |
707.78 Å 3 |
Surface Area |
502.88 Å 2 |
HOMO Energy |
-7.96 ± 0.55 eV |
LUMO Energy |
-0.73 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[[6-[[[2-(3-hydroxypropyl)-5-methyl-phenyl]amino]methyl]-2-(3-morpholin-4-ylpropylamino)benzimidazol-1-yl]methyl]-6-methyl-pyridin-3-ol
- 2-[[6-[[[2-(3-hydroxypropyl)-5-methyl-phenyl]amino]methyl]-2-(3-morpholinopropylamino)benzimidazol-1-yl]methyl]-6-methyl-pyridin-3-ol
- 2-[[6-[[[2-(3-hydroxypropyl)-5-methylphenyl]amino]methyl]-2-(3-morpholinopropylamino)-1-benzimidazolyl]methyl]-6-methyl-3-pyridinol
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InChIKey |
DKORMNNYNRPTBJ-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
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