2-(Butylamino)-4-[(Trans-4-Hydroxycyclohexyl)Amino]-N-(4-Sulfamoylbenzyl)-5-Pyrimidinecarboxamide

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Properties Simple | Detailed

Formula C22H32N6O4S
IUPAC Name 2-(butylamino)-4-[(4-hydroxycyclohexyl)amino]-n-[(4-sulfamoylphenyl)methyl]pyrimidine-5-carboxamide
Molecular Mass 476.592 g·mol−1
Heat of Formation -625.5 ± 16.7 kJ·mol−1
Dipole Moment 2.17 ± 1.08 D
Volume 557.2 Å 3
Surface Area 504.47 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 2.19 ± eV
Point Group Symmetry C1
InChIKey CQFHCAGCNILQLR-QAQDUYKDSA-N
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