N-[(2S,4S)-1-({4-[2-(3,5-Dimethyl-1,2-Oxazol-4-Yl)Ethyl]-1-Piperidinyl}Sulfonyl)-4-(5-Fluoro-2-Pyrimidinyl)-2-Methyl-2-Pentanyl]-N-Hydroxyformamide

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Properties Simple | Detailed

Formula C23H34FN5O5S
IUPAC Name n-[(1s,3s)-1-[[4-[2-(3,5-dimethylisoxazol-4-yl)ethyl]-1-piperidyl]sulfonylmethyl]-3-(5-fluoropyrimidin-2-yl)-1-methyl-butyl]-n-hydroxy-formamide
Molecular Mass 511.610 g·mol−1
Heat of Formation -707.8 ± 16.7 kJ·mol−1
Dipole Moment 3.99 ± 1.08 D
Volume 601.22 Å 3
Surface Area 482.75 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -0.82 ± eV
Point Group Symmetry C1
InChIKey UAGAABCJKYADIR-HJPURHCSSA-N
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