1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione
TL;DR: 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione (CAS 7414-92-8) is a chemical compound with molecular formula C19H12O4 and molecular weight 304.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,8-dihydroxy-3-methylbenzo[a]anthracene-7,12-dione
Also Known As: Tetrangulol, 1,8-dihydroxy-3-methyltetraphene-7,12-dione, 1,8-dihydroxy-3-methylbenzo[a]anthracene-7,12-dione, KST-1B8534, NCI60_001626
| Molecular Formula | C19H12O4 |
|---|---|
| Molecular Weight | 304.07 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 304.07355 |
| Heavy Atoms | 23 |
| Complexity | 515.0 |
Chemical Identifiers
| CAS Number | 7414-92-8 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1)O)C3=C(C=C2)C(=O)C4=C(C3=O)C=CC=C4O |
| InChIKey | NFUYRESOTVGLRL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione (CAS 7414-92-8), with molecular formula C19H12O4 and molecular weight 304.07 g/mol. IUPAC: 1,8-dihydroxy-3-methylbenzo[a]anthracene-7,12-dione.
Chemical Property Profile of 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione
Property Insights of 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione
The XLogP value of 4.3 indicates that 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione. Following Lipinski's Rule of Five, 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione has 2 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 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione?
The CAS number of 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione is 7414-92-8.
What is the molecular formula of 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione?
The molecular formula of 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione is C19H12O4.
What is the molecular weight of 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione?
The molecular weight of 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione is 304.07 g/mol.
Where can I buy 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione?
You can request a quote for 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.