4-(4-Amino-6-{[(1R)-1-(2-Naphthyl)Ethyl]Amino}-1,3,5-Triazin-2-Yl)-L-Phenylalanine

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Properties Simple | Detailed

Formula C24H24N6O2
IUPAC Name (2s)-2-amino-3-[4-[4-amino-6-[[(1r)-1-(2-naphthyl)ethyl]amino]-1,3,5-triazin-2-yl]phenyl]propanoic acid
Molecular Mass 428.486 g·mol−1
Heat of Formation 17.6 ± 16.7 kJ·mol−1
Dipole Moment 2.46 ± 1.08 D
Volume 510.65 Å 3
Surface Area 456.67 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-3-[4-[4-amino-6-[[(1r)-1-(2-naphthyl)ethyl]amino]-1,3,5-triazin-2-yl]phenyl]propanoic acid
  • (2s)-2-amino-3-[4-[4-amino-6-[[(1r)-1-(2-naphthyl)ethyl]amino]-s-triazin-2-yl]phenyl]propionic acid
  • (2s)-2-amino-3-[4-[4-amino-6-[[(1r)-1-naphthalen-2-ylethyl]amino]-1,3,5-triazin-2-yl]phenyl]propanoic acid
InChIKey UXYOCRLZKBFANG-VLIAUNLRSA-N
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