Methyl 1-[3-({[5-Carbamoyl-6-(3,4-Difluorophenyl)-4-Ethyl-2-Oxo-3,6-Dihydro-1(2H)-Pyrimidinyl]Carbonyl}Amino)Propyl]-4-Phenyl-4-Piperidinecarboxylate

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Properties Simple | Detailed

Formula C30H35F2N5O5
IUPAC Name methyl 1-[3-[[(4s)-5-carbamoyl-4-(3,4-difluorophenyl)-6-ethyl-2-oxo-1,4-dihydropyrimidine-3-carbonyl]amino]propyl]-4-phenyl-piperidine-4-carboxylate
Molecular Mass 583.626 g·mol−1
Heat of Formation -1124.6 ± 16.7 kJ·mol−1
Dipole Moment 6.58 ± 1.08 D
Volume 695.53 Å 3
Surface Area 516.06 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
InChIKey YCUQRVLXIFFFNB-VWLOTQADSA-N
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Elements H C N O F