Cis-4-({9-[(3S)-Tetrahydro-3-Furanyl]-8-[(2,4,6-Trifluorophenyl)Amino]-9H-Purin-2-Yl}Amino)Cyclohexanol
Properties
Property | Value |
---|---|
Formula | C21H23F3N6O2 |
IUPAC Name | 4-[[9-[(3s)-tetrahydrofuran-3-yl]-8-(2,4,6-trifluoroanilino)purin-2-yl]amino]cyclohexanol |
Molecular Mass | 448.442 g·mol−1 |
Heat of Formation | -555.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.67 ± 1.08 D |
Volume | 500.49 Å 3 |
Surface Area | 420.26 Å 2 |
HOMO Energy | -8.38 ± 0.55 eV |
LUMO Energy | -0.90 ± eV |
Point Group Symmetry | C1 |
InChIKey | IBGLGMOPHJQDJB-MELADBBJSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O F |