3,4,5-trimethoxy-N,N-dimethyl-benzamide
TL;DR: 3,4,5-trimethoxy-N,N-dimethyl-benzamide (CAS 5658-49-1) is a chemical compound with molecular formula C12H17NO4 and molecular weight 239.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-trimethoxy-N,N-dimethylbenzamide
Also Known As: 3,4,5-trimethoxy-N,N-dimethylbenzamide, 3,4,5-trimethoxy-N,N-dimethyl-benzamide, n,n-dimethyl-3,4,5-trimethoxybenzamide, 3,4,5-trimethoxy-benzoic acid dimethylamide, Benzamide, 3,4,5-trimethoxy-N,N-dimethyl-
| Molecular Formula | C12H17NO4 |
|---|---|
| Molecular Weight | 239.12 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 239.11575 |
| Heavy Atoms | 17 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 5658-49-1 |
|---|---|
| SMILES | CN(C)C(=O)C1=CC(=C(C(=C1)OC)OC)OC |
| InChIKey | YYAWRASCTAQQEK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4,5-trimethoxy-N,N-dimethyl-benzamide (CAS 5658-49-1), with molecular formula C12H17NO4 and molecular weight 239.12 g/mol. IUPAC: 3,4,5-trimethoxy-N,N-dimethylbenzamide.
Chemical Property Profile of 3,4,5-trimethoxy-N,N-dimethyl-benzamide
Property Insights of 3,4,5-trimethoxy-N,N-dimethyl-benzamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,5-trimethoxy-N,N-dimethyl-benzamide. With a topological polar surface area (TPSA) of 48.0 Ų, 3,4,5-trimethoxy-N,N-dimethyl-benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5-trimethoxy-N,N-dimethyl-benzamide has 0 hydrogen bond donor(s) and 4 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 3,4,5-trimethoxy-N,N-dimethyl-benzamide?
The CAS number of 3,4,5-trimethoxy-N,N-dimethyl-benzamide is 5658-49-1.
What is the molecular formula of 3,4,5-trimethoxy-N,N-dimethyl-benzamide?
The molecular formula of 3,4,5-trimethoxy-N,N-dimethyl-benzamide is C12H17NO4.
What is the molecular weight of 3,4,5-trimethoxy-N,N-dimethyl-benzamide?
The molecular weight of 3,4,5-trimethoxy-N,N-dimethyl-benzamide is 239.12 g/mol.
Where can I buy 3,4,5-trimethoxy-N,N-dimethyl-benzamide?
You can request a quote for 3,4,5-trimethoxy-N,N-dimethyl-benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5-trimethoxy-N,N-dimethyl-benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5-trimethoxy-N,N-dimethyl-benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.