(11As)-7-Methoxy-8-(3-{4-[6-(4-Methyl-1-Piperazinyl)-1H-Benzimidazol-2-Yl]Phenoxy}Propoxy)-1,2,3,10,11,11A-Hexahydro-5H-Pyrrolo[2,1-C][1,4]Benzodiazepin-5-One
Properties
| Property | Value |
|---|---|
| Formula | C34H40N6O4 |
| IUPAC Name | (6as)-2-methoxy-3-[3-[4-[6-(4-methylpiperazin-1-yl)-1h-benzimidazol-2-yl]phenoxy]propoxy]-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one |
| Molecular Mass | 596.719 g·mol−1 |
| Heat of Formation | -168.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.10 ± 1.08 D |
| Volume | 706.94 Å 3 |
| Surface Area | 621.13 Å 2 |
| HOMO Energy | -8.07 ± 0.55 eV |
| LUMO Energy | 2.55 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FHYBNKKZFOFFND-VWLOTQADSA-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 |