4-(4-Amino-1-Piperidinyl)-2-{[(2-Amino-5-Pyrimidinyl)Methyl]Amino}-5-Nitrobenzamide
Properties
| Property | Value |
|---|---|
| Formula | C17H22N8O3 |
| IUPAC Name | 4-(4-amino-1-piperidyl)-2-[(2-aminopyrimidin-5-yl)methylamino]-5-nitro-benzamide |
| Molecular Mass | 386.408 g·mol−1 |
| Heat of Formation | 28.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.07 ± 1.08 D |
| Volume | 439.22 Å 3 |
| Surface Area | 387.5 Å 2 |
| HOMO Energy | -8.94 ± 0.55 eV |
| LUMO Energy | 2.33 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YOJFGNJSVVXBNX-UHFFFAOYSA-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 |