Tcmdc-134674
Properties
| Property | Value |
|---|---|
| Formula | C38H52N4O6S |
| IUPAC Name | n3-[1-benzyl-2-hydroxy-3-[[1-(3-methoxyphenyl)-1-methyl-ethyl]amino]propyl]-5-(1,1-dioxothiazinan-2-yl)-n1,n1-dipropyl-benzene-1,3-dicarboxamide |
| Molecular Mass | 692.908 g·mol−1 |
| Heat of Formation | -949.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.32 ± 1.08 D |
| Volume | 868.39 Å 3 |
| Surface Area | 674.49 Å 2 |
| HOMO Energy | -8.95 ± 0.55 eV |
| LUMO Energy | -0.42 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KCQAMDDVQXZDMS-OIDHKYIRSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |