Sulpiride adamantanecarboxylate
TL;DR: Sulpiride adamantanecarboxylate (CAS 55247-89-7) is a chemical compound with molecular formula C26H39N3O6S and molecular weight 521.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
adamantane-1-carboxylic acid;N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxy-5-sulfamoylbenzamide
Also Known As: Sulpiride adamantanecarboxylate, EINECS 259-547-0, SULPIRIDE ADAMANTANECARBOXYLATE [WHO-DD], Tricyclo(3.3.1.13,7)decane-1-carboxylic acid, compound with 5-(aminosulphonyl)-N-((1-ethylpyrrolidin-2-yl)methyl)-2-methoxybenzamide(1:1), Adamantane-1-carboxylic acid--N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxy-5-sulfamoylbenzene-1-carboximidic acid (1/1)
| Molecular Formula | C26H39N3O6S |
|---|---|
| Molecular Weight | 521.26 g/mol |
| LogP | 2.8441 |
| Topological Polar Surface Area | 139.03 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 521.256 |
| Heavy Atoms | 36 |
| Complexity | 1053.8663 |
Chemical Identifiers
| CAS Number | 55247-89-7 |
|---|---|
| SMILES | CCN1CCCC1CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)OC.C1C2CC3CC1CC(C2)(C3)C(=O)O |
Product Overview
Sulpiride adamantanecarboxylate (CAS 55247-89-7), with molecular formula C26H39N3O6S and molecular weight 521.26 g/mol. IUPAC: adamantane-1-carboxylic acid;N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxy-5-sulfamoylbenzamide.
Chemical Property Profile of Sulpiride adamantanecarboxylate
Property Insights of Sulpiride adamantanecarboxylate
The XLogP value of 2.8441 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulpiride adamantanecarboxylate. The TPSA of 139.03 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulpiride adamantanecarboxylate. Following Lipinski's Rule of Five, Sulpiride adamantanecarboxylate has 3 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 Sulpiride adamantanecarboxylate?
The CAS number of Sulpiride adamantanecarboxylate is 55247-89-7.
What is the molecular formula of Sulpiride adamantanecarboxylate?
The molecular formula of Sulpiride adamantanecarboxylate is C26H39N3O6S.
What is the molecular weight of Sulpiride adamantanecarboxylate?
The molecular weight of Sulpiride adamantanecarboxylate is 521.26 g/mol.
Where can I buy Sulpiride adamantanecarboxylate?
You can request a quote for Sulpiride adamantanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulpiride adamantanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Sulpiride adamantanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.