TL;DR: (S)-4-(Aminocarbonyl)-1-(4-amino-4-carboxybutyl)pyridazinium chloride (CAS 115920-43-9) is a chemical compound with molecular formula C10H15ClN4O3 and molecular weight 274.08328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-amino-5-(4-carbamoylpyridazin-1-ium-1-yl)pentanoic acid chloride
Also Known As: Pyridazomycin, (S)-4-(Aminocarbonyl)-1-(4-amino-4-carboxybutyl)pyridazinium chloride, (2S)-2-amino-5-(4-carbamoylpyridazin-1-ium-1-yl)pentanoic acid;chloride, Pyridazinium, 4-(aminocarbonyl)-1-(4-amino-4-carboxybutyl)-, chloride, (S)-, (2S)-2-amino-5-(4-carbamoylpyridazin-1-ium-1-yl)pentanoic acid chloride
| Molecular Formula | C10H15ClN4O3 |
| Molecular Weight | 274.08328 g/mol |
| XLogP | -4.3359 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 274.08328 Da |
| Heavy Atoms | 18 |
| Complexity | 285.0 |
| SMILES | C1=C[N+](=NC=C1C(=O)N)CCC[C@@H](C(=O)O)N.[Cl-] |
| InChIKey | UNLIMPSYAWNGDA-QRPNPIFTSA-N |
The XLogP value of -4.3359 indicates that (S)-4-(Aminocarbonyl)-1-(4-amino-4-carboxybutyl)pyridazinium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-4-(Aminocarbonyl)-1-(4-amino-4-carboxybutyl)pyridazinium chloride. Following Lipinski's Rule of Five, (S)-4-(Aminocarbonyl)-1-(4-amino-4-carboxybutyl)pyridazinium chloride has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (S)-4-(Aminocarbonyl)-1-(4-amino-4-carboxybutyl)pyridazinium chloride is 115920-43-9.
The molecular formula of (S)-4-(Aminocarbonyl)-1-(4-amino-4-carboxybutyl)pyridazinium chloride is C10H15ClN4O3.
The molecular weight of (S)-4-(Aminocarbonyl)-1-(4-amino-4-carboxybutyl)pyridazinium chloride is 274.08328 g/mol.
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