Formula |
C21H24BrN5O |
IUPAC Name |
2-[4-(5-bromo-3-methyl-2-pyridyl)butylamino]-5-[(6-methyl-3-pyridyl)methyl]pyrimidin-4-one |
Molecular Mass |
442.352 g·mol−1 |
Heat of Formation |
57.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.85 ± 1.08 D |
Volume |
484.57 Å 3 |
Surface Area |
438.64 Å 2 |
HOMO Energy |
-9.03 ± 0.55 eV |
LUMO Energy |
-0.63 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-((4-(5-bromo-3-methyl-2-pyridyl)butyl)amino)-5-((6-methyl-3-pyridyl)methyl)-4(1h)-pyrimidinone
- 2-[4-(5-bromo-3-methyl-2-pyridyl)butylamino]-5-[(6-methyl-3-pyridyl)methyl]-3h-pyrimidin-4-one
- 2-[4-(5-bromo-3-methyl-pyridin-2-yl)butylamino]-5-[(6-methylpyridin-3-yl)methyl]-3h-pyrimidin-4-one
- 2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[(6-methylpyridin-3-yl)methyl]-3h-pyrimidin-4-one
- 4(1h)-pyrimidinone, 2-((4-(5-bromo-3-methyl-2-pyridinyl)butyl)amino)-5-((6-methyl-3-pyridinyl)methyl)-
- d06063
- pdsp1_000119
- pdsp2_000119
- sk&f 93944
- sk&f-93944
- temelastina [spanish]
- temelastine
- temelastine (usan)
- temelastinum [latin]
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CAS Number(s) |
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InChIKey |
OGEAASSLWZDQBM-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
O
Br
N
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