Soluflazine
TL;DR: Soluflazine (CAS 734499-99-1) is a chemical compound with molecular formula C28H30Cl2FN5O2 and molecular weight 557.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(2,6-dichloroanilino)-2-oxoethyl]-1-[4-(4-fluorophenyl)-4-pyridin-3-ylbutyl]piperazine-2-carboxamide
Also Known As: Soluflazine, 4-(2-((2,6-Dichlorophenyl)amino)-2-oxoethyl)-1-(4-(4-fluorophenyl)-4-(pyridin-3-yl)butyl)piperazine-2-carboxamide, 4-[2-(2,6-dichloroanilino)-2-oxoethyl]-1-[4-(4-fluorophenyl)-4-pyridin-3-ylbutyl]piperazine-2-carboxamide, 4-{[(2,6-dichlorophenyl)carbamoyl]methyl}-1-[4-(4-fluorophenyl)-4-(pyridin-3-yl)butyl]piperazine-2-carboxamide, 4-{2-[(2,6-dichlorophenyl)amino]-2-oxoethyl}-1-[4-(4-fluorophenyl)-4-(pyridin-3-yl)butyl]piperazine-2-carboxamide
| Molecular Formula | C28H30Cl2FN5O2 |
|---|---|
| Molecular Weight | 557.18 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 557.1761 |
| Heavy Atoms | 38 |
| Complexity | 762.0 |
Chemical Identifiers
| CAS Number | 734499-99-1 |
|---|---|
| SMILES | C1CN(C(CN1CC(=O)NC2=C(C=CC=C2Cl)Cl)C(=O)N)CCCC(C3=CC=C(C=C3)F)C4=CN=CC=C4 |
| InChIKey | AJMNLJRNCSAACN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Soluflazine (CAS 734499-99-1), with molecular formula C28H30Cl2FN5O2 and molecular weight 557.18 g/mol. IUPAC: 4-[2-(2,6-dichloroanilino)-2-oxoethyl]-1-[4-(4-fluorophenyl)-4-pyridin-3-ylbutyl]piperazine-2-carboxamide.
Chemical Property Profile of Soluflazine
Property Insights of Soluflazine
The XLogP value of 4.4 indicates that Soluflazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Soluflazine. Following Lipinski's Rule of Five, Soluflazine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Soluflazine?
The CAS number of Soluflazine is 734499-99-1.
What is the molecular formula of Soluflazine?
The molecular formula of Soluflazine is C28H30Cl2FN5O2.
What is the molecular weight of Soluflazine?
The molecular weight of Soluflazine is 557.18 g/mol.
Where can I buy Soluflazine?
You can request a quote for Soluflazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Soluflazine?
Yes, KEHONG BIO provides custom synthesis services for Soluflazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.