7-Amino-7-Benzyl-N-[5-Carbamimidamido-1-Hydroxy-1-(1,3-Thiazol-2-Yl)-2-Pentanyl]-8-Oxohexahydro-1H-Pyrazolo[1,2-A]Pyridazine-1-Carboxamide
Properties
Property | Value |
---|---|
Formula | C24H34N8O3S |
IUPAC Name | (3s,6s,9r)-6-amino-6-benzyl-n-[(1s)-4-guanidino-1-[(s)-hydroxy(thiazol-2-yl)methyl]butyl]-5-oxo-2,3,7,8-tetrahydro-1h-pyrazolo[1,2-a]pyridazine-3-carboxamide |
Molecular Mass | 514.644 g·mol−1 |
Heat of Formation | -191.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.29 ± 1.08 D |
Volume | 607.24 Å 3 |
Surface Area | 478.86 Å 2 |
HOMO Energy | -8.52 ± 0.55 eV |
LUMO Energy | -0.82 ± eV |
Point Group Symmetry | C1 |
InChIKey | LWWRAASQNZOVDU-GSRZOBFVSA-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 |