N-(1-Cyclohexyl-4-Piperidyl)-2-(4-Isopropyl-1,4-Diazepan-1-Yl)-6-Methoxy-7-[3-(1-Piperidyl)Propoxy]Quinazolin-4-Amine

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Properties Simple | Detailed

Formula C36H59N7O2
IUPAC Name n-(1-cyclohexyl-4-piperidyl)-2-[(1r,4s)-4-isopropyl-1,4-diazepan-1-yl]-6-methoxy-7-[3-(1-piperidyl)propoxy]quinazolin-4-amine
Molecular Mass 621.899 g·mol−1
Heat of Formation -293.7 ± 16.7 kJ·mol−1
Dipole Moment 4.44 ± 1.08 D
Volume 809.93 Å 3
Surface Area 604.4 Å 2
HOMO Energy -7.78 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry C1
InChIKey OUKWLRHRXOPODD-UHFFFAOYSA-N
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