Tretoquinol, (A+-)-
TL;DR: Tretoquinol, (A+-)- (CAS 21650-42-0) is a chemical compound with molecular formula C19H23NO5 and molecular weight 345.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol
Also Known As: Tretoquinol, Inolin, DL-Trimetoquinol, Trimethoquinol, Tretoquinol [MI]
| Molecular Formula | C19H23NO5 |
|---|---|
| Molecular Weight | 345.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 80.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.15762 |
| Heavy Atoms | 25 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 21650-42-0 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)CC2C3=CC(=C(C=C3CCN2)O)O |
| InChIKey | RGVPOXRFEPSFGH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tretoquinol, (A+-)- (CAS 21650-42-0), with molecular formula C19H23NO5 and molecular weight 345.16 g/mol. IUPAC: 1-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol.
Chemical Property Profile of Tretoquinol, (A+-)-
Property Insights of Tretoquinol, (A+-)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tretoquinol, (A+-)-. The TPSA of 80.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Tretoquinol, (A+-)-. Following Lipinski's Rule of Five, Tretoquinol, (A+-)- has 3 hydrogen bond donor(s) and 6 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 Tretoquinol, (A+-)-?
The CAS number of Tretoquinol, (A+-)- is 21650-42-0.
What is the molecular formula of Tretoquinol, (A+-)-?
The molecular formula of Tretoquinol, (A+-)- is C19H23NO5.
What is the molecular weight of Tretoquinol, (A+-)-?
The molecular weight of Tretoquinol, (A+-)- is 345.16 g/mol.
Where can I buy Tretoquinol, (A+-)-?
You can request a quote for Tretoquinol, (A+-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tretoquinol, (A+-)-?
Yes, KEHONG BIO provides custom synthesis services for Tretoquinol, (A+-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.