(3S,8Ar)-2-{(2S)-2-Cyclohexyl-2-[(N-Methyl-L-Alanyl)Amino]Acetyl}-N-[(1R)-1,2,3,4-Tetrahydro-1-Naphthalenyl]Octahydropyrrolo[1,2-A]Pyrazine-3-Carboxamide
Properties
Property | Value |
---|---|
Formula | C30H45N5O3 |
IUPAC Name | (3s,5r,8ar)-2-[(2s)-2-cyclohexyl-2-[[(2s)-2-(methylamino)propanoyl]amino]acetyl]-n-[(1r)-tetralin-1-yl]-3,4,6,7,8,8a-hexahydro-1h-pyrrolo[1,2-a]pyrazine-3-carboxamide |
Molecular Mass | 523.710 g·mol−1 |
Heat of Formation | -587.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.80 ± 1.08 D |
Volume | 668.97 Å 3 |
Surface Area | 512.94 Å 2 |
HOMO Energy | -8.93 ± 0.55 eV |
LUMO Energy | 3.30 ± eV |
Point Group Symmetry | C1 |
InChIKey | STMKHYWFPMLFAV-PWZZVKMOSA-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 |