Methyl e-3-carboxamide
TL;DR: Methyl e-3-carboxamide (CAS 445022-66-2) is a chemical compound with molecular formula C26H22N2O4 and molecular weight 426.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(3-ethoxyphenyl)quinoline-4-carbonyl]amino]benzoate
Also Known As: methyl e-3-carboxamide, methyl 2-[[2-(3-ethoxyphenyl)quinoline-4-carbonyl]amino]benzoate, methyl 2-({[2-(3-ethoxyphenyl)quinolin-4-yl]carbonyl}amino)benzoate, methyl 2-{[2-(3-ethoxyphenyl)-4-quinolyl]carbonylamino}benzoate, METHYL 2-({[2-(3-ETHOXYPHENYL)-4-QUINOLYL]CARBONYL}AMINO)BENZOATE
| Molecular Formula | C26H22N2O4 |
|---|---|
| Molecular Weight | 426.16 g/mol |
| LogP | 5.3394 |
| Topological Polar Surface Area | 77.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.15796 |
| Heavy Atoms | 32 |
| Complexity | 1300.0074 |
Chemical Identifiers
| CAS Number | 445022-66-2 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=CC=C4C(=O)OC |
Product Overview
Methyl e-3-carboxamide (CAS 445022-66-2), with molecular formula C26H22N2O4 and molecular weight 426.16 g/mol. IUPAC: methyl 2-[[2-(3-ethoxyphenyl)quinoline-4-carbonyl]amino]benzoate.
Chemical Property Profile of Methyl e-3-carboxamide
Property Insights of Methyl e-3-carboxamide
The XLogP value of 5.3394 indicates that Methyl e-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.52 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl e-3-carboxamide. Following Lipinski's Rule of Five, Methyl e-3-carboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl e-3-carboxamide?
The CAS number of Methyl e-3-carboxamide is 445022-66-2.
What is the molecular formula of Methyl e-3-carboxamide?
The molecular formula of Methyl e-3-carboxamide is C26H22N2O4.
What is the molecular weight of Methyl e-3-carboxamide?
The molecular weight of Methyl e-3-carboxamide is 426.16 g/mol.
Where can I buy Methyl e-3-carboxamide?
You can request a quote for Methyl e-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl e-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for Methyl e-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.