7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione
TL;DR: 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione (CAS 67390-39-0) is a chemical compound with molecular formula C18H18O4 and molecular weight 298.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione
Also Known As: 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione, 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e], 7-Methoxy-3a-methyl-3a,4,5,10,11,11a-hexahydrophenanthro[1,2-c]furan-1,3-dione
| Molecular Formula | C18H18O4 |
|---|---|
| Molecular Weight | 298.12 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.1205 |
| Heavy Atoms | 22 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 67390-39-0 |
|---|---|
| SMILES | CC12C(CCC3=C1CCC4=C3C=CC(=C4)OC)C(=O)OC2=O |
| InChIKey | GMONDBYKIPBMHG-UHFFFAOYSA-N |
Product Overview
7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione (CAS 67390-39-0), with molecular formula C18H18O4 and molecular weight 298.12 g/mol. IUPAC: 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione.
Chemical Property Profile of 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione
Property Insights of 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione. With a topological polar surface area (TPSA) of 52.6 Ų, 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione has 0 hydrogen bond donor(s) and 4 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 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione?
The CAS number of 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione is 67390-39-0.
What is the molecular formula of 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione?
The molecular formula of 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione is C18H18O4.
What is the molecular weight of 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione?
The molecular weight of 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione is 298.12 g/mol.
Where can I buy 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione?
You can request a quote for 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-methoxy-3a-methyl-5,10,11,11a-tetrahydro-4H-naphtho[2,1-e][2]benzofuran-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.