TL;DR: Minopafant (CAS 128420-61-1) is a chemical compound with molecular formula C46H73ClN4O9 and molecular weight 860.5066 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R)-3-[(1-ethylpyridin-1-ium-2-yl)methyl-(2-methoxybenzoyl)carbamoyl]oxy-2-methoxypropyl] 4-(octadecylcarbamoyloxy)piperidine-1-carboxylate chloride
Also Known As: Minopafant, Menopafant, minopafantum, Minopafant [INN], Minopafant chloride
| Molecular Formula | C46H73ClN4O9 |
| Molecular Weight | 860.5066 g/mol |
| XLogP | 6.3893 |
| Topological Polar Surface Area (TPSA) | 137.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 31 |
| Exact Mass | 860.5066 Da |
| Heavy Atoms | 60 |
| Complexity | 1150.0 |
| SMILES | CCCCCCCCCCCCCCCCCCNC(=O)OC1CCN(CC1)C(=O)OC[C@H](COC(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3OC)OC.[Cl-] |
| InChIKey | IXRMFSBOHHRXSS-YPMTVOEDSA-N |
The XLogP value of 6.3893 indicates that Minopafant is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Minopafant. Following Lipinski's Rule of Five, Minopafant has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Minopafant is 128420-61-1.
The molecular formula of Minopafant is C46H73ClN4O9.
The molecular weight of Minopafant is 860.5066 g/mol.
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