(2E)-3-(4-{[(1-{[(13-Cyclohexyl-6-Oxo-6,7-Dihydro-5H-Indolo[1,2-D][1,4]Benzodiazepin-10-Yl)Carbonyl]Amino}Cyclopentyl)Carbonyl]Amino}Phenyl)Acrylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C38H38N4O5 |
| IUPAC Name | (e)-3-[4-[[1-[(13-cyclohexyl-6-oxo-5,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carbonyl)amino]cyclopentanecarbonyl]amino]phenyl]prop-2-enoic acid |
| Molecular Mass | 630.732 g·mol−1 |
| Heat of Formation | -573.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 10.22 ± 1.08 D |
| Volume | 745.07 Å 3 |
| Surface Area | 616.07 Å 2 |
| HOMO Energy | -8.67 ± 0.55 eV |
| LUMO Energy | -1.02 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HDBNVTWMHMMKNY-XMHGGMMESA-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 |