Pavezan
TL;DR: Pavezan (CAS 102395-75-5) is a chemical compound with molecular formula C63H85NO19 and molecular weight 1159.57 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(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 | 1159.57 g/mol |
| LogP | 6.77 |
| Topological Polar Surface Area | 308.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 13 |
| Exact Mass | 1159.5715 |
| Heavy Atoms | 83 |
| Complexity | 2140.0 |
Chemical Identifiers
| CAS Number | 102395-75-5 |
|---|---|
| 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 |
Product Overview
Pavezan (CAS 102395-75-5), with molecular formula C63H85NO19 and molecular weight 1159.57 g/mol. IUPAC: (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.
Chemical Property Profile of Pavezan
Property Insights of Pavezan
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.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pavezan?
The CAS number of Pavezan is 102395-75-5.
What is the molecular formula of Pavezan?
The molecular formula of Pavezan is C63H85NO19.
What is the molecular weight of Pavezan?
The molecular weight of Pavezan is 1159.57 g/mol.
Where can I buy Pavezan?
You can request a quote for Pavezan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pavezan?
Yes, KEHONG BIO provides custom synthesis services for Pavezan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.