2-[4-Amino-2-[(1R,2S)-2-Methylcyclohexoxy]-5-Oxo-Pyrido[2,3-D]Pyrimidin-8-Yl]Acetonitrile
Properties
Property | Value |
---|---|
Formula | C16H19N5O2 |
IUPAC Name | 2-[4-amino-2-[(1s,2r)-2-methylcyclohexoxy]-5-oxo-pyrido[2,3-d]pyrimidin-8-yl]acetonitrile |
Molecular Mass | 313.354 g·mol−1 |
Heat of Formation | -108.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.30 ± 1.08 D |
Volume | 372.53 Å 3 |
Surface Area | 321.87 Å 2 |
HOMO Energy | -9.50 ± 0.55 eV |
LUMO Energy | -0.87 ± eV |
Point Group Symmetry | C1 |
InChIKey | MZUFVSMPTFUMGZ-PWSUYJOCSA-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 |