6-{5-[(2-Amino-4-Pyrimidinyl)Amino]-2-Hydroxyphenyl}-N-Methylene-1-Benzothiophene-2-Carboxamide
Properties
Property | Value |
---|---|
Formula | C20H15N5O2S |
IUPAC Name | 6-[5-[(2-aminopyrimidin-4-yl)amino]-2-hydroxy-phenyl]-n-methylene-benzothiophene-2-carboxamide |
Molecular Mass | 389.430 g·mol−1 |
Heat of Formation | 186.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.12 ± 1.08 D |
Volume | 439.6 Å 3 |
Surface Area | 392.54 Å 2 |
HOMO Energy | -8.55 ± 0.55 eV |
LUMO Energy | -1.67 ± eV |
Point Group Symmetry | C1 |
InChIKey | KCQAKLMJFBAMFX-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | H C S O N |