拉帕醇
TL;DR: 拉帕醇 (CAS 84-79-7) is a chemical compound with molecular formula C15H14O3 and molecular weight 242.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
拉帕醇
4-hydroxy-3-(3-methylbut-2-enyl)naphthalene-1,2-dione
Also Known As: lapachol, Greenhartin, Tecomin, Bethabarra wood, Taiguic acid
| Molecular Formula | C15H14O3 |
|---|---|
| Molecular Weight | 242.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.0943 |
| Heavy Atoms | 18 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 84-79-7 |
|---|---|
| SMILES | CC(=CCC1=C(C2=CC=CC=C2C(=O)C1=O)O)C |
| InChIKey | CWPGNVFCJOPXFB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
拉帕醇 (CAS 84-79-7), with molecular formula C15H14O3 and molecular weight 242.09 g/mol. IUPAC: 4-hydroxy-3-(3-methylbut-2-enyl)naphthalene-1,2-dione.
Chemical Property Profile of 拉帕醇
Property Insights of 拉帕醇
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 拉帕醇. With a topological polar surface area (TPSA) of 54.4 Ų, 拉帕醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 拉帕醇 has 1 hydrogen bond donor(s) and 3 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 拉帕醇?
The CAS number of 拉帕醇 is 84-79-7.
What is the molecular formula of 拉帕醇?
The molecular formula of 拉帕醇 is C15H14O3.
What is the molecular weight of 拉帕醇?
The molecular weight of 拉帕醇 is 242.09 g/mol.
Where can I buy 拉帕醇?
You can request a quote for 拉帕醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 拉帕醇?
Yes, KEHONG BIO provides custom synthesis services for 拉帕醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.