TL;DR: Pavezan (CAS 102395-75-5) is a chemical compound with molecular formula C63H85NO19 and molecular weight 1159.5715 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3S,4S,5R,6S)-6-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-5-[(1R,2R,3S,4R,5S)-5-carboxy-2,3,4-trihydroxycyclohexyl]oxy-3,4-dihydroxyoxane-2-carboxylic acid;1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline
Also Known As: Pavezan, Papaverine glycyrrhizinate, Papaverina glicirrizinato, Papaverina glicirrizinato [Italian], 1-((3,4-Dimethoxyphenyl)methyl)-6,7-dimethoxy-isoquinoline glycyrrhizinate
| Molecular Formula | C63H85NO19 |
| Molecular Weight | 1159.5715 g/mol |
| XLogP | 6.77 |
| Topological Polar Surface Area (TPSA) | 308.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 13 |
| Exact Mass | 1159.5715 Da |
| Heavy Atoms | 83 |
| Complexity | 2140.0 |
| SMILES | C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O[C@@H]7C[C@@H]([C@H]([C@@H]([C@H]7O)O)O)C(=O)O)C)(C)C(=O)O.COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC |
| InChIKey | AJVFRECHHYUSKO-FYSHDTCASA-N |
The XLogP value of 6.77 indicates that Pavezan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 308.0 Ų indicates high polarity, suggesting Pavezan may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pavezan has 8 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Pavezan is 102395-75-5.
The molecular formula of Pavezan is C63H85NO19.
The molecular weight of Pavezan is 1159.5715 g/mol.
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