Formula |
C18H19N5O3 |
IUPAC Name |
4-[2-[2-(4-pyridyl)-4,5-dihydroimidazol-1-yl]ethylcarbamoylamino]benzoic acid |
Molecular Mass |
353.375 g·mol−1 |
Heat of Formation |
-229.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.86 ± 1.08 D |
Volume |
411.56 Å 3 |
Surface Area |
344.82 Å 2 |
HOMO Energy |
-9.15 ± 0.55 eV |
LUMO Energy |
2.36 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1-(2-(2-(4-pyridyl)-2-imidazoline-1-yl)ethyl)-3-(4-carboxyphenyl)urea
- 4-[2-(2-pyridin-4-yl-4,5-dihydroimidazol-1-yl)ethylcarbamoylamino]benzoic acid
- 4-[[oxo-[2-[2-(4-pyridyl)-4,5-dihydroimidazol-1-yl]ethylamino]methyl]amino]benzoic acid
- benzoic acid, 4-((((2-(4,5-dihydro-2-(4-pyridinyl)-1h-imidazol-1-yl)ethyl)amino)carbonyl)amino)-
- cgp 15720 a
- cgp 15720a
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CAS Number(s) |
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InChIKey |
QBVPWMWOTZZZRZ-UHFFFAOYSA-N |
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Elements |
H
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