(2R,4S)-1-[2-(4-{[4-(3,4-Dichlorophenyl)-1,3-Thiazol-2-Yl]Amino}Phenyl)Ethyl]-2-(Hydroxymethyl)-4-Piperidinol
Properties
| Property | Value |
|---|---|
| Formula | C23H25Cl2N3O2S |
| IUPAC Name | (1s,2r,4s)-1-[2-[4-[[4-(3,4-dichlorophenyl)thiazol-2-yl]amino]phenyl]ethyl]-2-(hydroxymethyl)piperidin-4-ol |
| Molecular Mass | 478.435 g·mol−1 |
| Heat of Formation | -118.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.09 ± 1.08 D |
| Volume | 542.69 Å 3 |
| Surface Area | 467.64 Å 2 |
| HOMO Energy | -8.63 ± 0.55 eV |
| LUMO Energy | -1.34 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SQJKFWCRPARYPY-MOPGFXCFSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C Cl H O N S |