N-(5-{[3-Amino-1-(3-Chlorophenyl)Propyl]Carbamoyl}-2-Chlorophenyl)-2-Methoxy-7-Oxo-1,7-Dihydropyrido[2,3-D]Pyrimidine-6-Carboxamide

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Properties Simple | Detailed

Formula C25H22Cl2N6O4+
IUPAC Name n-[5-[[(1r)-3-amino-1-(3-chlorophenyl)propyl]carbamoyl]-2-chloro-phenyl]-2-methoxy-7-oxo-pyrido[2,3-d]pyrimidine-6-carboxamide
Molecular Mass 541.386 g·mol−1
Heat of Formation -361.6 ± 16.7 kJ·mol−1
Dipole Moment 5.74 ± 1.08 D
Volume 586.6 Å 3
Surface Area 516.48 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy 1.17 ± eV
Point Group Symmetry C1
InChIKey KUFCYNGJQRKYSQ-LJQANCHMSA-N
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