4-{[5-(Cyclohexylamino)[1,2,4]Triazolo[1,5-A]Pyrimidin-7-Yl]Amino}Benzenesulfonamide
Properties
| Property | Value |
|---|---|
| Formula | C17H21N7O2S |
| IUPAC Name | 4-[[4-(cyclohexylamino)-5,7-diaza-1-azonia-9-azanidabicyclo[4.3.0]nona-1(6),2,4,7-tetraen-2-yl]amino]benzenesulfonamide |
| Molecular Mass | 387.459 g·mol−1 |
| Heat of Formation | 69.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.27 ± 1.08 D |
| Volume | 432.47 Å 3 |
| Surface Area | 386.19 Å 2 |
| HOMO Energy | -9.02 ± 0.55 eV |
| LUMO Energy | -1.51 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VPOGRVWIIVMWRI-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |