普伐他汀
TL;DR: 普伐他汀 (CAS 81093-37-0) is a chemical compound with molecular formula C23H36O7 and molecular weight 424.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
普伐他汀
3,5-dihydroxy-7-[6-hydroxy-2-methyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]heptanoic acid
Also Known As: pravastatin, Pravastatin Impurity A, I06-0261, BRD-A11170096-001-01-8, 3,5-dihydroxy-7-[6-hydroxy-2-methyl-8-(2-methyl-1-oxobutoxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]heptanoic acid
| Molecular Formula | C23H36O7 |
|---|---|
| Molecular Weight | 424.25 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 424.2461 |
| Heavy Atoms | 30 |
| Complexity | 656.0 |
Chemical Identifiers
| CAS Number | 81093-37-0 |
|---|---|
| SMILES | CCC(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC(CC(CC(=O)O)O)O)O |
| InChIKey | TUZYXOIXSAXUGO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
普伐他汀 (CAS 81093-37-0), with molecular formula C23H36O7 and molecular weight 424.25 g/mol. IUPAC: 3,5-dihydroxy-7-[6-hydroxy-2-methyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]heptanoic acid.
Chemical Property Profile of 普伐他汀
Property Insights of 普伐他汀
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 普伐他汀. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 普伐他汀. Following Lipinski's Rule of Five, 普伐他汀 has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 普伐他汀?
The CAS number of 普伐他汀 is 81093-37-0.
What is the molecular formula of 普伐他汀?
The molecular formula of 普伐他汀 is C23H36O7.
What is the molecular weight of 普伐他汀?
The molecular weight of 普伐他汀 is 424.25 g/mol.
Where can I buy 普伐他汀?
You can request a quote for 普伐他汀 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 普伐他汀?
Yes, KEHONG BIO provides custom synthesis services for 普伐他汀 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.