亚甲基丹参醌
TL;DR: 亚甲基丹参醌 (CAS 67656-29-5) is a chemical compound with molecular formula C18H14O3 and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
亚甲基丹参醌
1-methyl-6-methylidene-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione
Also Known As: Methylenetanshinquinone, methylenetanshinone, methylene salianolate, Methylenetanshiquinone, Tanshinquinone, methylene-
| Molecular Formula | C18H14O3 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 47.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 278.0943 |
| Heavy Atoms | 21 |
| Complexity | 509.0 |
Chemical Identifiers
| CAS Number | 67656-29-5 |
|---|---|
| SMILES | CC1=COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4=C |
| InChIKey | QDFFAXSMLUUJSG-UHFFFAOYSA-N |
Product Overview
亚甲基丹参醌 (CAS 67656-29-5), with molecular formula C18H14O3 and molecular weight 278.09 g/mol. IUPAC: 1-methyl-6-methylidene-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione.
Chemical Property Profile of 亚甲基丹参醌
Property Insights of 亚甲基丹参醌
The XLogP value of 3.3 indicates that 亚甲基丹参醌 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.3 Ų, 亚甲基丹参醌 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 亚甲基丹参醌 has 0 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 亚甲基丹参醌?
The CAS number of 亚甲基丹参醌 is 67656-29-5.
What is the molecular formula of 亚甲基丹参醌?
The molecular formula of 亚甲基丹参醌 is C18H14O3.
What is the molecular weight of 亚甲基丹参醌?
The molecular weight of 亚甲基丹参醌 is 278.09 g/mol.
Where can I buy 亚甲基丹参醌?
You can request a quote for 亚甲基丹参醌 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 亚甲基丹参醌?
Yes, KEHONG BIO provides custom synthesis services for 亚甲基丹参醌 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.