硫酸司巴丁
TL;DR: 硫酸司巴丁 (CAS 6160-12-9) is a chemical compound with molecular formula C15H38N2O9S and molecular weight 422.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸司巴丁
(1R,2S,9R,10R)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecane;sulfuric acid;pentahydrate
Also Known As: SPARTEINE SULFATE, lupinidine, Sparteine sulphate, Sparteinum sulphuricum, Sparteine sulfate pentahydrate
| Molecular Formula | C15H38N2O9S |
|---|---|
| Molecular Weight | 422.23 g/mol |
| LogP | -2.43 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 0 |
| Exact Mass | 422.2298 |
| Heavy Atoms | 27 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 6160-12-9 |
|---|---|
| SMILES | C1CCN2C[C@H]3C[C@@H]([C@H]2C1)CN4[C@H]3CCCC4.O.O.O.O.O.OS(=O)(=O)O |
| InChIKey | WNSDDGBLIALDPB-HTZKOJAYSA-N |
Product Overview
硫酸司巴丁 (CAS 6160-12-9), with molecular formula C15H38N2O9S and molecular weight 422.23 g/mol. IUPAC: (1R,2S,9R,10R)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecane;sulfuric acid;pentahydrate.
Chemical Property Profile of 硫酸司巴丁
Property Insights of 硫酸司巴丁
The XLogP value of -2.43 indicates that 硫酸司巴丁 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 硫酸司巴丁. Following Lipinski's Rule of Five, 硫酸司巴丁 has 7 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 硫酸司巴丁?
The CAS number of 硫酸司巴丁 is 6160-12-9.
What is the molecular formula of 硫酸司巴丁?
The molecular formula of 硫酸司巴丁 is C15H38N2O9S.
What is the molecular weight of 硫酸司巴丁?
The molecular weight of 硫酸司巴丁 is 422.23 g/mol.
Where can I buy 硫酸司巴丁?
You can request a quote for 硫酸司巴丁 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸司巴丁?
Yes, KEHONG BIO provides custom synthesis services for 硫酸司巴丁 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.