![methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate structure](/static/products/823/823832-75-3.png)
methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate
TL;DR: methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate (CAS 823832-75-3) is a chemical compound with molecular formula C24H18N2O5S and molecular weight 446.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[2-(1,3-benzodioxol-5-yl)-6-methylquinoline-4-carbonyl]amino]thiophene-2-carboxylate
Also Known As: methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate, methyl 3-(2-(benzo[d][1,3]dioxol-5-yl)-6-methylquinoline-4-carboxamido)thiophene-2-carboxylate, methyl 3-[(2-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-6-methyl-4-quinolyl)carbonylam ino]thiophene-2-carboxylate, Methyl 3-[(2-benzo[1,3]dioxol-5-yl-6-methyl-quinoline-4-carbonyl)amino]thiophene-2-carboxylate, methyl 3-[[2-(1,3-benzodioxol-5-yl)-6-methylquinoline-4-carbonyl]amino]thiophene-2-carboxylate
| Molecular Formula | C24H18N2O5S |
|---|---|
| Molecular Weight | 446.09 g/mol |
| LogP | 5.03932 |
| Topological Polar Surface Area | 86.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 446.09363 |
| Heavy Atoms | 32 |
| Complexity | 1378.3298 |
Chemical Identifiers
| CAS Number | 823832-75-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(SC=C3)C(=O)OC)C4=CC5=C(C=C4)OCO5 |
Product Overview
methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate (CAS 823832-75-3), with molecular formula C24H18N2O5S and molecular weight 446.09 g/mol. IUPAC: methyl 3-[[2-(1,3-benzodioxol-5-yl)-6-methylquinoline-4-carbonyl]amino]thiophene-2-carboxylate.
Chemical Property Profile of methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate
Property Insights of methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate
The XLogP value of 5.03932 indicates that methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.75 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate. Following Lipinski's Rule of Five, methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate?
The CAS number of methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate is 823832-75-3.
What is the molecular formula of methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate?
The molecular formula of methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate is C24H18N2O5S.
What is the molecular weight of methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate?
The molecular weight of methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate is 446.09 g/mol.
Where can I buy methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate?
You can request a quote for methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-({[2-(1,3-benzodioxol-5-yl)-6-methylquinolin-4-yl]carbonyl}amino)thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.