(3S)-3-[[(5S,8R)-2-(3-Carboxypropyl)-8-[2-[[2-(4-Chlorophenyl)Acetyl]Amino]Ethyl]-1,3-Dioxo-5,8-Dihydro-[1,2,4]Triazolo[1,2-A]Pyridazine-5-Carbonyl]Amino]-4-Oxo-Pentanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C26H30ClN5O9 |
| IUPAC Name | (3s)-3-[[(5s,8r)-2-(3-carboxypropyl)-8-[2-[[2-(4-chlorophenyl)acetyl]amino]ethyl]-1,3-dioxo-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5-carbonyl]amino]-4-oxo-pentanoic acid |
| Molecular Mass | 591.997 g·mol−1 |
| Heat of Formation | -1490.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.49 ± 1.08 D |
| Volume | 668.5 Å 3 |
| Surface Area | 524.6 Å 2 |
| HOMO Energy | -9.52 ± 0.55 eV |
| LUMO Energy | -0.26 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FCUBCMCZKNHBIS-UFYCRDLUSA-N |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C Cl O N |