n-Isobutyl-3,5-dimethoxy-4-methylbenzamide
TL;DR: n-Isobutyl-3,5-dimethoxy-4-methylbenzamide (CAS 794563-53-4) is a chemical compound with molecular formula C14H21NO3 and molecular weight 251.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethoxy-4-methyl-N-(2-methylpropyl)benzamide
Also Known As: n-Isobutyl-3,5-dimethoxy-4-methylbenzamide, 3,5-dimethoxy-4-methyl-N-(2-methylpropyl)benzamide
| Molecular Formula | C14H21NO3 |
|---|---|
| Molecular Weight | 251.15 g/mol |
| LogP | 2.39802 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 251.15215 |
| Heavy Atoms | 18 |
| Complexity | 402.04245 |
Chemical Identifiers
| CAS Number | 794563-53-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1OC)C(=O)NCC(C)C)OC |
Product Overview
n-Isobutyl-3,5-dimethoxy-4-methylbenzamide (CAS 794563-53-4), with molecular formula C14H21NO3 and molecular weight 251.15 g/mol. IUPAC: 3,5-dimethoxy-4-methyl-N-(2-methylpropyl)benzamide.
Chemical Property Profile of n-Isobutyl-3,5-dimethoxy-4-methylbenzamide
Property Insights of n-Isobutyl-3,5-dimethoxy-4-methylbenzamide
The XLogP value of 2.39802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-Isobutyl-3,5-dimethoxy-4-methylbenzamide. With a topological polar surface area (TPSA) of 47.56 Ų, n-Isobutyl-3,5-dimethoxy-4-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Isobutyl-3,5-dimethoxy-4-methylbenzamide has 1 hydrogen bond donor(s) and 3 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-3,5-dimethoxy-4-methylbenzamide?
The CAS number of n-Isobutyl-3,5-dimethoxy-4-methylbenzamide is 794563-53-4.
What is the molecular formula of n-Isobutyl-3,5-dimethoxy-4-methylbenzamide?
The molecular formula of n-Isobutyl-3,5-dimethoxy-4-methylbenzamide is C14H21NO3.
What is the molecular weight of n-Isobutyl-3,5-dimethoxy-4-methylbenzamide?
The molecular weight of n-Isobutyl-3,5-dimethoxy-4-methylbenzamide is 251.15 g/mol.
Where can I buy n-Isobutyl-3,5-dimethoxy-4-methylbenzamide?
You can request a quote for n-Isobutyl-3,5-dimethoxy-4-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Isobutyl-3,5-dimethoxy-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for n-Isobutyl-3,5-dimethoxy-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.