N-(5-{[3-(4-Amino-6-Methyl-1,3,5-Triazin-2-Yl)-5-(Tetrahydro-2H-Pyran-4-Yl)-2-Pyridinyl]Amino}-2-Chloro-3-Pyridinyl)Methanesulfonamide

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Properties Simple | Detailed

Formula C20H23ClN8O3S
IUPAC Name n-[5-[[3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-5-tetrahydropyran-4-yl-2-pyridyl]amino]-2-chloro-3-pyridyl]methanesulfonamide
Molecular Mass 490.966 g·mol−1
Heat of Formation -202.9 ± 16.7 kJ·mol−1
Dipole Moment 8.19 ± 1.08 D
Volume 529.08 Å 3
Surface Area 452.49 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy -1.25 ± eV
Point Group Symmetry C1
InChIKey FLBPZSHGOYHCPK-UHFFFAOYSA-N
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