(4R,5S,6S,7R)-1-[(3-Amino-1H-Indazol-5-Yl)Methyl]-4,7-Dibenzyl-3-Butyl-5,6-Dihydroxy-1,3-Diazepan-2-One
Properties
Property | Value |
---|---|
Formula | C31H37N5O3 |
IUPAC Name | (4r,5s,6s,7r)-1-[(3-amino-1h-indazol-5-yl)methyl]-4,7-dibenzyl-3-butyl-5,6-dihydroxy-1,3-diazepan-2-one |
Molecular Mass | 527.657 g·mol−1 |
Heat of Formation | -200.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.87 ± 1.08 D |
Volume | 652.87 Å 3 |
Surface Area | 502.48 Å 2 |
HOMO Energy | -8.26 ± 0.55 eV |
LUMO Energy | -0.40 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | CGEJBZXGNPASAG-GKQHHHCTSA-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 |