Ketanserin tartrate
TL;DR: Ketanserin tartrate (CAS 89820-22-4) is a chemical compound with molecular formula C26H28FN3O9 and molecular weight 545.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydroxybutanedioic acid;3-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione
Also Known As: Ketanserin tartrate, ketanserin tartarate, KETANSERINTARTRATE, Ketanserin (tartrate), Lopac0_001191
| Molecular Formula | C26H28FN3O9 |
|---|---|
| Molecular Weight | 545.18 g/mol |
| LogP | 0.3012 |
| Topological Polar Surface Area | 185.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 545.18097 |
| Heavy Atoms | 39 |
| Complexity | 761.0 |
Chemical Identifiers
| CAS Number | 89820-22-4 |
|---|---|
| SMILES | C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCN3C(=O)C4=CC=CC=C4NC3=O.C(C(C(=O)O)O)(C(=O)O)O |
| InChIKey | KMTLTEVOQLMYRS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ketanserin tartrate (CAS 89820-22-4), with molecular formula C26H28FN3O9 and molecular weight 545.18 g/mol. IUPAC: 2,3-dihydroxybutanedioic acid;3-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione.
Chemical Property Profile of Ketanserin tartrate
Property Insights of Ketanserin tartrate
The XLogP value of 0.3012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ketanserin tartrate. The TPSA of 185.0 Ų indicates high polarity, suggesting Ketanserin tartrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ketanserin tartrate has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ketanserin tartrate?
The CAS number of Ketanserin tartrate is 89820-22-4.
What is the molecular formula of Ketanserin tartrate?
The molecular formula of Ketanserin tartrate is C26H28FN3O9.
What is the molecular weight of Ketanserin tartrate?
The molecular weight of Ketanserin tartrate is 545.18 g/mol.
Where can I buy Ketanserin tartrate?
You can request a quote for Ketanserin tartrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ketanserin tartrate?
Yes, KEHONG BIO provides custom synthesis services for Ketanserin tartrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.