![N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide structure](/static/products/3139/313981-96-3.webp)
N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide
TL;DR: N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide (CAS 313981-96-3) is a chemical compound with molecular formula C18H21N3O5 and molecular weight 359.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]pyridine-4-carboxamide
Also Known As: N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide, AB00117422-01, AI-981/36684014, N-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]pyridine-4-carboxamide, N-(2-(3,4,5-trimethoxybenzamido)ethyl)isonicotinamide
| Molecular Formula | C18H21N3O5 |
|---|---|
| Molecular Weight | 359.15 g/mol |
| LogP | 1.2672 |
| Topological Polar Surface Area | 98.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 359.14813 |
| Heavy Atoms | 26 |
| Complexity | 739.67194 |
Chemical Identifiers
| CAS Number | 313981-96-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NCCNC(=O)C2=CC=NC=C2 |
Product Overview
N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide (CAS 313981-96-3), with molecular formula C18H21N3O5 and molecular weight 359.15 g/mol. IUPAC: N-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]pyridine-4-carboxamide.
Chemical Property Profile of N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide
Property Insights of N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide
The XLogP value of 1.2672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide. The TPSA of 98.78 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide. Following Lipinski's Rule of Five, N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide has 2 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-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide?
The CAS number of N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide is 313981-96-3.
What is the molecular formula of N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide?
The molecular formula of N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide is C18H21N3O5.
What is the molecular weight of N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide?
The molecular weight of N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide is 359.15 g/mol.
Where can I buy N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide?
You can request a quote for N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-{2-[(3,4,5-trimethoxybenzoyl)amino]ethyl}isonicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.