TL;DR: Matlystatin D (CAS 140638-25-1) is a chemical compound with molecular formula C27H44N6O6 and molecular weight 548.3322 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-methyl-1-[[2-[2-[2-(oxidoamino)-2-oxoethyl]heptanoyl]diazinane-3-carbonyl]amino]butyl]-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-9-ium-5-carboxylic acid
Also Known As: Matlystatin D, Matlystatin D1, 3-[2-methyl-1-[[2-[2-[2-(oxidoamino)-2-oxoethyl]heptanoyl]diazinane-3-carbonyl]amino]butyl]-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-9-ium-5-carboxylic acid, [(3-{6-[{[1-(8-Carboxy-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-9-ium-1-yl)-2-methylbutyl]imino}(hydroxy)methyl]-1,2-diazinane-1-carbonyl}-1-hydroxyoctylidene)amino]oxidanide, 3-(1-((2-(2-(2-(hydroxyamino)-2-oxoethyl)heptanoyl)diazinane-3-carbonyl)amino)-2-methylbutyl)-5,6,7,8-tetrahydropyrazolo(1,2-a)pyridazin-9-ium-5-carboxylate
| Molecular Formula | C27H44N6O6 |
| Molecular Weight | 548.3322 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 160.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 548.3322 Da |
| Heavy Atoms | 39 |
| Complexity | 859.0 |
| SMILES | CCCCCC(CC(=O)N[O-])C(=O)N1C(CCCN1)C(=O)NC(C2=CC=[N+]3N2C(CCC3)C(=O)O)C(C)CC |
| InChIKey | ZWXPBQLKZALQOQ-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Matlystatin D. The TPSA of 160.0 Ų indicates high polarity, suggesting Matlystatin D may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Matlystatin D has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Matlystatin D is 140638-25-1.
The molecular formula of Matlystatin D is C27H44N6O6.
The molecular weight of Matlystatin D is 548.3322 g/mol.
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