N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide
TL;DR: N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide (CAS 757213-59-5) is a chemical compound with molecular formula C17H17NO6 and molecular weight 331.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide
Also Known As: BAS 07398966, N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide, N-Benzo[1,3]dioxol-5-yl-2,4,5-trimethoxy-benzamide
| Molecular Formula | C17H17NO6 |
|---|---|
| Molecular Weight | 331.11 g/mol |
| LogP | 2.6934 |
| Topological Polar Surface Area | 75.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.1056 |
| Heavy Atoms | 24 |
| Complexity | 773.9163 |
Chemical Identifiers
| CAS Number | 757213-59-5 |
|---|---|
| SMILES | COC1=CC(=C(C=C1C(=O)NC2=CC3=C(C=C2)OCO3)OC)OC |
Product Overview
N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide (CAS 757213-59-5), with molecular formula C17H17NO6 and molecular weight 331.11 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide
Property Insights of N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide
The XLogP value of 2.6934 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide. The TPSA of 75.25 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide 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 N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide?
The CAS number of N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide is 757213-59-5.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide is C17H17NO6.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide is 331.11 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-2,4,5-trimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.