Formula |
C30H31ClN4O4 |
IUPAC Name |
2-[(1r)-1-[4-[2-(4-chlorophenoxy)acetyl]piperazin-1-yl]ethyl]-3-(2-ethoxyphenyl)quinazolin-4-one |
Molecular Mass |
547.045 g·mol−1 |
Heat of Formation |
-343.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.79 ± 1.08 D |
Volume |
635.26 Å 3 |
Surface Area |
454.42 Å 2 |
HOMO Energy |
-8.95 ± 0.55 eV |
LUMO Energy |
-1.03 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
BKQFRNYHFIQEKN-OAQYLSRUSA-N |
QR Code |
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Links |
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Elements |
H
C
N
O
Cl
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