Formula |
C22H21N5O2 |
IUPAC Name |
n-[(1s)-1-(4-imidazol-1-ylphenyl)ethyl]-3-(4-oxo-1h-quinazolin-2-yl)propanamide |
Molecular Mass |
387.434 g·mol−1 |
Heat of Formation |
2.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.41 ± 1.08 D |
Volume |
460.53 Å 3 |
Surface Area |
420.08 Å 2 |
HOMO Energy |
-9.33 ± 0.55 eV |
LUMO Energy |
-1.18 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- n-[(1s)-1-(4-imidazol-1-ylphenyl)ethyl]-3-(4-keto-1h-quinazolin-2-yl)propionamide
- n-[(1s)-1-[4-(1-imidazolyl)phenyl]ethyl]-3-(4-oxo-1h-quinazolin-2-yl)propanamide
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InChIKey |
CXFUNVLSNZEBDZ-HNNXBMFYSA-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
N
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