3,4,5-triethoxy-N-isobutylbenzamide
TL;DR: 3,4,5-triethoxy-N-isobutylbenzamide (CAS 349114-97-2) is a chemical compound with molecular formula C17H27NO4 and molecular weight 309.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-triethoxy-N-(2-methylpropyl)benzamide
Also Known As: 3,4,5-triethoxy-N-isobutylbenzamide, 3,4,5-triethoxy-N-(2-methylpropyl)benzamide, AN-652/11989782
| Molecular Formula | C17H27NO4 |
|---|---|
| Molecular Weight | 309.19 g/mol |
| LogP | 3.2685 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 309.194 |
| Heavy Atoms | 22 |
| Complexity | 458.54245 |
Chemical Identifiers
| CAS Number | 349114-97-2 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NCC(C)C |
Product Overview
3,4,5-triethoxy-N-isobutylbenzamide (CAS 349114-97-2), with molecular formula C17H27NO4 and molecular weight 309.19 g/mol. IUPAC: 3,4,5-triethoxy-N-(2-methylpropyl)benzamide.
Chemical Property Profile of 3,4,5-triethoxy-N-isobutylbenzamide
Property Insights of 3,4,5-triethoxy-N-isobutylbenzamide
The XLogP value of 3.2685 indicates that 3,4,5-triethoxy-N-isobutylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.79 Ų, 3,4,5-triethoxy-N-isobutylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5-triethoxy-N-isobutylbenzamide 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 3,4,5-triethoxy-N-isobutylbenzamide?
The CAS number of 3,4,5-triethoxy-N-isobutylbenzamide is 349114-97-2.
What is the molecular formula of 3,4,5-triethoxy-N-isobutylbenzamide?
The molecular formula of 3,4,5-triethoxy-N-isobutylbenzamide is C17H27NO4.
What is the molecular weight of 3,4,5-triethoxy-N-isobutylbenzamide?
The molecular weight of 3,4,5-triethoxy-N-isobutylbenzamide is 309.19 g/mol.
Where can I buy 3,4,5-triethoxy-N-isobutylbenzamide?
You can request a quote for 3,4,5-triethoxy-N-isobutylbenzamide 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-triethoxy-N-isobutylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5-triethoxy-N-isobutylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.