(5S,11R,11As)-11-[(4-Fluorophenyl)Amino]-5-(4-Hydroxy-3,5-Dimethoxyphenyl)-5,6,11,11A-Tetrahydro-1H-[1,3]Oxazolo[3',4':1,6]Pyrido[3,4-B]Indol-3-One
Properties
| Property | Value |
|---|---|
| Formula | C27H24FN3O5 |
| IUPAC Name | (10s,15s,16r)-16-(4-fluoroanilino)-10-(4-hydroxy-3,5-dimethoxy-phenyl)-13-oxa-8,11-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6-tetraen-12-one |
| Molecular Mass | 489.495 g·mol−1 |
| Heat of Formation | -590.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.50 ± 1.08 D |
| Volume | 545.96 Å 3 |
| Surface Area | 425.12 Å 2 |
| HOMO Energy | -8.59 ± 0.55 eV |
| LUMO Energy | -0.45 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KRGUDELVCQGRQE-VPHKFGTKSA-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 |