(5S)-5'-O-(5-Amino-5-Deoxy-β-D-Ribofuranosyl)-5'-C-{(2S)-5-[(4-Butylphenyl)Carbamoyl]-1,4-Dimethyl-3-Oxo-2,3,4,7-Tetrahydro-1H-1,4-Diazepin-2-Yl}Uridine

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Formula C32H44N6O11++
IUPAC Name (1r,2s)-2-[(s)-[(2s,3r,4s,5r)-5-(aminomethyl)-3,4-dihydroxy-tetrahydrofuran-2-yl]oxy-[(2s,3s,4r,5r)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]-n-(4-butylphenyl)-1,4-dimethyl-3-oxo-2,7-dihydro-1,4-diazepine-5-carboxamide
Molecular Mass 688.725 g·mol−1
Heat of Formation -1824.8 ± 16.7 kJ·mol−1
Dipole Moment 2.63 ± 1.08 D
Volume 794.5 Å 3
Surface Area 605.08 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy -0.56 ± eV
Point Group Symmetry C1
InChIKey RQVDLVWYEOCAJE-KDHSHZOVSA-N
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