2-{[(3R,4R)-3-Aminotetrahydro-2H-Pyran-4-Yl]Amino}-4-[(4-Methylphenyl)Amino]-5-Pyrimidinecarboxamide
Properties
Property | Value |
---|---|
Formula | C17H22N6O2 |
IUPAC Name | 2-[[(3r,4r)-3-aminotetrahydropyran-4-yl]amino]-4-(4-methylanilino)pyrimidine-5-carboxamide |
Molecular Mass | 342.396 g·mol−1 |
Heat of Formation | -171.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.06 ± 1.08 D |
Volume | 403.77 Å 3 |
Surface Area | 359.91 Å 2 |
HOMO Energy | -8.64 ± 0.55 eV |
LUMO Energy | 2.41 ± eV |
Point Group Symmetry | C1 |
InChIKey | KBPYMFSSFLOJPH-UONOGXRCSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |