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
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Synonyms
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- (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
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InChIKey |
UXYOCRLZKBFANG-VLIAUNLRSA-N |
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Elements |
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