N-isobutyl-2,4,5-trimethoxybenzamide
TL;DR: N-isobutyl-2,4,5-trimethoxybenzamide (CAS 52751-89-0) is a chemical compound with molecular formula C14H21NO4 and molecular weight 267.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,5-trimethoxy-N-(2-methylpropyl)benzamide
Also Known As: N-isobutyl-2,4,5-trimethoxybenzamide, 2,4,5-trimethoxy-N-(2-methylpropyl)benzamide, Benzamide, 2,4,5-trimethoxy-N-(2-methylpropyl)-, AN-652/43024825
| Molecular Formula | C14H21NO4 |
|---|---|
| Molecular Weight | 267.15 g/mol |
| LogP | 2.0982 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 267.14706 |
| Heavy Atoms | 19 |
| Complexity | 443.31726 |
Chemical Identifiers
| CAS Number | 52751-89-0 |
|---|---|
| SMILES | CC(C)CNC(=O)C1=CC(=C(C=C1OC)OC)OC |
Product Overview
N-isobutyl-2,4,5-trimethoxybenzamide (CAS 52751-89-0), with molecular formula C14H21NO4 and molecular weight 267.15 g/mol. IUPAC: 2,4,5-trimethoxy-N-(2-methylpropyl)benzamide.
Chemical Property Profile of N-isobutyl-2,4,5-trimethoxybenzamide
Property Insights of N-isobutyl-2,4,5-trimethoxybenzamide
The XLogP value of 2.0982 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-isobutyl-2,4,5-trimethoxybenzamide. With a topological polar surface area (TPSA) of 56.79 Ų, N-isobutyl-2,4,5-trimethoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-isobutyl-2,4,5-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-isobutyl-2,4,5-trimethoxybenzamide?
The CAS number of N-isobutyl-2,4,5-trimethoxybenzamide is 52751-89-0.
What is the molecular formula of N-isobutyl-2,4,5-trimethoxybenzamide?
The molecular formula of N-isobutyl-2,4,5-trimethoxybenzamide is C14H21NO4.
What is the molecular weight of N-isobutyl-2,4,5-trimethoxybenzamide?
The molecular weight of N-isobutyl-2,4,5-trimethoxybenzamide is 267.15 g/mol.
Where can I buy N-isobutyl-2,4,5-trimethoxybenzamide?
You can request a quote for N-isobutyl-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-isobutyl-2,4,5-trimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-isobutyl-2,4,5-trimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.