9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)-
TL;DR: 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)- (CAS 161920-51-0) is a chemical compound with molecular formula C17H12N4O4 and molecular weight 336.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dimethoxy-6-(2H-tetrazol-5-yl)anthracene-9,10-dione
Also Known As: 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)-, 1,4-dimethoxy-6-(2H-tetrazol-5-yl)anthracene-9,10-dione, 5-(9,10-Dihydro-5,8-dimethoxy-9,10-dioxoanthracene-2-yl)-1H-tetrazole
| Molecular Formula | C17H12N4O4 |
|---|---|
| Molecular Weight | 336.09 g/mol |
| LogP | 1.6593 |
| Topological Polar Surface Area | 107.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 336.08585 |
| Heavy Atoms | 25 |
| Complexity | 1011.73737 |
Chemical Identifiers
| CAS Number | 161920-51-0 |
|---|---|
| SMILES | COC1=C2C(=C(C=C1)OC)C(=O)C3=C(C2=O)C=CC(=C3)C4=NNN=N4 |
Product Overview
9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)- (CAS 161920-51-0), with molecular formula C17H12N4O4 and molecular weight 336.09 g/mol. IUPAC: 1,4-dimethoxy-6-(2H-tetrazol-5-yl)anthracene-9,10-dione.
Chemical Property Profile of 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)-
Property Insights of 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)-
The XLogP value of 1.6593 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)-. The TPSA of 107.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)-. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)- has 1 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 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)-?
The CAS number of 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)- is 161920-51-0.
What is the molecular formula of 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)-?
The molecular formula of 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)- is C17H12N4O4.
What is the molecular weight of 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)-?
The molecular weight of 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)- is 336.09 g/mol.
Where can I buy 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)-?
You can request a quote for 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 1,4-dimethoxy-6-(1H-tetrazol-5-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.