Trimebutine maleate
TL;DR: Trimebutine maleate (CAS 58997-92-5) is a chemical compound with molecular formula C26H33NO9 and molecular weight 503.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[2-phenyl-1-(3,4,5-trimethoxybenzoyl)oxybutan-2-yl]azanium;(Z)-4-hydroxy-4-oxobut-2-enoate
Also Known As: Trimebutine maleate, 2-(Dimethylamino)-2-phenylbutyl 3,4,5-trimethoxybenzoate maleate, dimethyl-[2-phenyl-1-(3,4,5-trimethoxybenzoyl)oxybutan-2-yl]azanium;(Z)-4-hydroxy-4-oxobut-2-enoate, dimethyl-[2-phenyl-1-(3,4,5-trimethoxybenzoyl)oxybutan-2-yl]azanium; (Z)-4-hydroxy-4-oxobut-2-enoate
| Molecular Formula | C26H33NO9 |
|---|---|
| Molecular Weight | 503.22 g/mol |
| LogP | 0.6963 |
| Topological Polar Surface Area | 135.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 503.21555 |
| Heavy Atoms | 36 |
| Complexity | 1009.63043 |
Chemical Identifiers
| CAS Number | 58997-92-5 |
|---|---|
| SMILES | CCC(COC(=O)C1=CC(=C(C(=C1)OC)OC)OC)(C2=CC=CC=C2)[NH+](C)C.C(=C\C(=O)[O-])\C(=O)O |
Product Overview
Trimebutine maleate (CAS 58997-92-5), with molecular formula C26H33NO9 and molecular weight 503.22 g/mol. IUPAC: dimethyl-[2-phenyl-1-(3,4,5-trimethoxybenzoyl)oxybutan-2-yl]azanium;(Z)-4-hydroxy-4-oxobut-2-enoate.
Chemical Property Profile of Trimebutine maleate
Property Insights of Trimebutine maleate
The XLogP value of 0.6963 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trimebutine maleate. The TPSA of 135.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Trimebutine maleate. Following Lipinski's Rule of Five, Trimebutine maleate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Trimebutine maleate?
The CAS number of Trimebutine maleate is 58997-92-5.
What is the molecular formula of Trimebutine maleate?
The molecular formula of Trimebutine maleate is C26H33NO9.
What is the molecular weight of Trimebutine maleate?
The molecular weight of Trimebutine maleate is 503.22 g/mol.
Where can I buy Trimebutine maleate?
You can request a quote for Trimebutine maleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trimebutine maleate?
Yes, KEHONG BIO provides custom synthesis services for Trimebutine maleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.