Trimethobenzamide
TL;DR: Trimethobenzamide (CAS 138-56-7) is a chemical compound with molecular formula C21H28N2O5 and molecular weight 388.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-3,4,5-trimethoxybenzamide
Also Known As: trimethobenzamide, Tigan, Trimetobenzamida, emedur, Tribenzagan
| Molecular Formula | C21H28N2O5 |
|---|---|
| Molecular Weight | 388.20 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 69.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 388.19983 |
| Heavy Atoms | 28 |
| Complexity | 440.0 |
| Melting Point | 188.7 |
| Solubility | 40 |
Chemical Identifiers
| CAS Number | 138-56-7 |
|---|---|
| SMILES | CN(C)CCOC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C(=C2)OC)OC)OC |
| InChIKey | FEZBIKUBAYAZIU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trimethobenzamide (CAS 138-56-7), with molecular formula C21H28N2O5 and molecular weight 388.20 g/mol. IUPAC: N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-3,4,5-trimethoxybenzamide.
Chemical Property Profile of Trimethobenzamide
Property Insights of Trimethobenzamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trimethobenzamide. The TPSA of 69.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Trimethobenzamide. Following Lipinski's Rule of Five, Trimethobenzamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Trimethobenzamide?
The CAS number of Trimethobenzamide is 138-56-7.
What is the molecular formula of Trimethobenzamide?
The molecular formula of Trimethobenzamide is C21H28N2O5.
What is the molecular weight of Trimethobenzamide?
The molecular weight of Trimethobenzamide is 388.20 g/mol.
Where can I buy Trimethobenzamide?
You can request a quote for Trimethobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trimethobenzamide?
Yes, KEHONG BIO provides custom synthesis services for Trimethobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.