3-(2-{4-[(4-Fluorophenyl)(Hydroxy)Methyl]-1-Piperidinyl}Ethyl)-2,4(1H,3H)-Quinazolinedione

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Properties Simple | Detailed

Formula C22H24FN3O3
IUPAC Name 3-[2-[4-[(r)-(4-fluorophenyl)-hydroxy-methyl]-1-piperidyl]ethyl]-1h-quinazoline-2,4-dione
Molecular Mass 397.443 g·mol−1
Heat of Formation -574.5 ± 16.7 kJ·mol−1
Dipole Moment 6.24 ± 1.08 D
Volume 459.95 Å 3
Surface Area 401.32 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy -0.90 ± eV
Point Group Symmetry C1
InChIKey CSAITASUWRGAOT-HXUWFJFHSA-N
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