N-Benzyl-3,4,5-trimethoxybenzamide
TL;DR: N-Benzyl-3,4,5-trimethoxybenzamide (CAS 3940-84-9) is a chemical compound with molecular formula C17H19NO4 and molecular weight 301.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-3,4,5-trimethoxybenzamide
Also Known As: N-benzyl-3,4,5-trimethoxybenzamide, ChemDiv3_001221, 3,4,5-TRIMETHOXY-N-(PHENYLMETHYL)BENZAMIDE, IDI1_020187, N-benzyl(3,4,5-trimethoxyphenyl)carboxamide
| Molecular Formula | C17H19NO4 |
|---|---|
| Molecular Weight | 301.13 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 301.1314 |
| Heavy Atoms | 22 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 3940-84-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NCC2=CC=CC=C2 |
| InChIKey | IUHYGONSJUAHBM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Benzyl-3,4,5-trimethoxybenzamide (CAS 3940-84-9), with molecular formula C17H19NO4 and molecular weight 301.13 g/mol. IUPAC: N-benzyl-3,4,5-trimethoxybenzamide.
Chemical Property Profile of N-Benzyl-3,4,5-trimethoxybenzamide
Property Insights of N-Benzyl-3,4,5-trimethoxybenzamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzyl-3,4,5-trimethoxybenzamide. With a topological polar surface area (TPSA) of 56.8 Ų, N-Benzyl-3,4,5-trimethoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Benzyl-3,4,5-trimethoxybenzamide has 1 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 N-Benzyl-3,4,5-trimethoxybenzamide?
The CAS number of N-Benzyl-3,4,5-trimethoxybenzamide is 3940-84-9.
What is the molecular formula of N-Benzyl-3,4,5-trimethoxybenzamide?
The molecular formula of N-Benzyl-3,4,5-trimethoxybenzamide is C17H19NO4.
What is the molecular weight of N-Benzyl-3,4,5-trimethoxybenzamide?
The molecular weight of N-Benzyl-3,4,5-trimethoxybenzamide is 301.13 g/mol.
Where can I buy N-Benzyl-3,4,5-trimethoxybenzamide?
You can request a quote for N-Benzyl-3,4,5-trimethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzyl-3,4,5-trimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-Benzyl-3,4,5-trimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.