2-(4-(3-(Tert-Butylamino)-2-Hydroxypropoxy)Phenyl)-3-Methyl-6-Methoxy-4(3H)-Quinazolinone

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Properties Simple | Detailed

Formula C23H29N3O4
IUPAC Name 2-[4-[(2r)-3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-6-methoxy-3-methyl-quinazolin-4-one
Molecular Mass 411.494 g·mol−1
Heat of Formation -515.0 ± 16.7 kJ·mol−1
Dipole Moment 1.17 ± 1.08 D
Volume 506.15 Å 3
Surface Area 421.89 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
InChIKey NJLURZOPCFJTSE-MRXNPFEDSA-N
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