Formula |
C23H21N7O |
IUPAC Name |
n-[4-(aminomethyl)phenyl]-6-carbamimidoyl-4-(pyrimidin-2-ylamino)naphthalene-2-carboxamide |
Molecular Mass |
411.459 g·mol−1 |
Heat of Formation |
350.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.63 ± 1.08 D |
Volume |
482.76 Å 3 |
Surface Area |
431.49 Å 2 |
HOMO Energy |
-8.72 ± 0.55 eV |
LUMO Energy |
-1.34 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 6-[(z)-amino(imino)methyl]-n-[4-(aminomethyl)phenyl]-4-(pyrimidin-2-ylamino)-2-naphthamide
- 6-amidino-n-[4-(aminomethyl)phenyl]-4-(pyrimidin-2-ylamino)-2-naphthamide
- n-[4-(aminomethyl)phenyl]-6-carbamimidoyl-4-(pyrimidin-2-ylamino)naphthalene-2-carboxamide
- ui1
|
InChIKey |
CSWQJKHBMACTGB-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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|
Elements |
H
C
O
N
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