(4R)-1-[(3-Cyanophenyl)Sulfonyl]-4-(3,3-Difluoro-1-Piperidinyl)-L-Prolyl-4-[(3,5-Dichloroisonicotinoyl)Amino]-L-Phenylalanine
Properties
| Property | Value |
|---|---|
| Formula | C32H30Cl2F2N6O6S |
| IUPAC Name | (2s)-2-[[(1r,2s,4r)-1-(3-cyanophenyl)sulfonyl-4-[(1r)-3,3-difluoro-1-piperidyl]pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid |
| Molecular Mass | 735.585 g·mol−1 |
| Heat of Formation | -1118.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.50 ± 1.08 D |
| Volume | 798.29 Å 3 |
| Surface Area | 583.09 Å 2 |
| HOMO Energy | -8.93 ± 0.55 eV |
| LUMO Energy | -1.42 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QPHITNQZXAUFEI-ICTDUYRTSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C F H Cl O N S |