But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one
TL;DR: But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one (CAS 17360-35-9) is a chemical compound with molecular formula C36H48N4O14 and molecular weight 760.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(but-2-enedioic acid);bis(1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one)
Also Known As: oxotremorine sesquifumarate, Oxotremorine fumarate (2:3), tris(fumaric acid); bis(oxotremorine), C12H18N2O.3/2C4H4O4, C12-H18-N2-O.3/2C4-H4-O4
| Molecular Formula | C36H48N4O14 |
|---|---|
| Molecular Weight | 760.32 g/mol |
| LogP | 0.55 |
| Topological Polar Surface Area | 271.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 10 |
| Exact Mass | 760.3167 |
| Heavy Atoms | 54 |
| Complexity | 412.0 |
Chemical Identifiers
| CAS Number | 17360-35-9 |
|---|---|
| SMILES | C1CCN(C1)CC#CCN2CCCC2=O.C1CCN(C1)CC#CCN2CCCC2=O.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O |
| InChIKey | WLYYOFJEBGHKEC-UHFFFAOYSA-N |
Product Overview
But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one (CAS 17360-35-9), with molecular formula C36H48N4O14 and molecular weight 760.32 g/mol. IUPAC: tris(but-2-enedioic acid);bis(1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one).
Chemical Property Profile of But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one
Property Insights of But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one
The XLogP value of 0.55 suggests moderate lipophilicity, balancing water solubility and membrane permeability for But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one. The TPSA of 271.0 Ų indicates high polarity, suggesting But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one has 6 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one?
The CAS number of But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one is 17360-35-9.
What is the molecular formula of But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one?
The molecular formula of But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one is C36H48N4O14.
What is the molecular weight of But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one?
The molecular weight of But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one is 760.32 g/mol.
Where can I buy But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one?
You can request a quote for But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for But-2-enedioic acid;1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.