Stelabid
TL;DR: Stelabid (CAS 60108-70-5) is a chemical compound with molecular formula C44H59Cl2F3IN5OS and molecular weight 959.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-amino-4-oxo-3,3-diphenylbutyl)-methyl-di(propan-2-yl)azanium;10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine;iodide;dihydrochloride
Also Known As: Stelabid, Isopropamide iodide mixture with trifluoperazine, Isopropamide iodide mixture with trifluoperazine dihydrochloride, (4-amino-4-oxo-3,3-diphenylbutyl)-methyl-di(propan-2-yl)azanium;10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine;iodide;dihydrochloride, 2,7(1H)-Isoquinolinedisulfonamide, N7-(3-chlorophenyl)-N2-((7-(((3-chlorophenyl)amino)sulfonyl)-3,4-dihydro-2(1H)-isoquinolinyl)sulfonyl)-3,4-dihydro-
| Molecular Formula | C44H59Cl2F3IN5OS |
|---|---|
| Molecular Weight | 959.28 g/mol |
| LogP | 6.9047 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 959.28143 |
| Heavy Atoms | 57 |
| Complexity | 929.0 |
Chemical Identifiers
| CAS Number | 60108-70-5 |
|---|---|
| SMILES | CC(C)[N+](C)(CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N)C(C)C.CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F.Cl.Cl.[I-] |
| InChIKey | SQNMQDPDOSETHS-UHFFFAOYSA-N |
Product Overview
Stelabid (CAS 60108-70-5), with molecular formula C44H59Cl2F3IN5OS and molecular weight 959.28 g/mol. IUPAC: (4-amino-4-oxo-3,3-diphenylbutyl)-methyl-di(propan-2-yl)azanium;10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine;iodide;dihydrochloride.
Chemical Property Profile of Stelabid
Property Insights of Stelabid
The XLogP value of 6.9047 indicates that Stelabid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Stelabid. Following Lipinski's Rule of Five, Stelabid has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Stelabid?
The CAS number of Stelabid is 60108-70-5.
What is the molecular formula of Stelabid?
The molecular formula of Stelabid is C44H59Cl2F3IN5OS.
What is the molecular weight of Stelabid?
The molecular weight of Stelabid is 959.28 g/mol.
Where can I buy Stelabid?
You can request a quote for Stelabid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stelabid?
Yes, KEHONG BIO provides custom synthesis services for Stelabid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.