TL;DR: (3S)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;nitric acid (CAS 15104-99-1) is a chemical compound with molecular formula C11H17N3O5 and molecular weight 271.11682 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;nitric acid
Also Known As: Pilofrin, Pilagan, Pilocarpine nitrate, Pilocarpine mononitrate, Pilocarpine, mononitrate
| Molecular Formula | C11H17N3O5 |
| Molecular Weight | 271.11682 g/mol |
| XLogP | 0.81 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.11682 Da |
| Heavy Atoms | 19 |
| Complexity | 269.0 |
| SMILES | CC[C@H]1C(COC1=O)CC2=CN=CN2C.[N+](=O)(O)[O-] |
| InChIKey | PRZXEPJJHQYOGF-LQRGNCEWSA-N |
The XLogP value of 0.81 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3S)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;nitric acid. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (3S)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;nitric acid. Following Lipinski's Rule of Five, (3S)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;nitric acid has 1 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 (3S)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;nitric acid is 15104-99-1.
The molecular formula of (3S)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;nitric acid is C11H17N3O5.
The molecular weight of (3S)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;nitric acid is 271.11682 g/mol.
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