3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate
TL;DR: 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate (CAS 724747-48-2) is a chemical compound with molecular formula C21H18N2O4S and molecular weight 394.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[[3-methyl-4-(thiophene-2-carbonylamino)phenyl]carbamoyl]phenyl] acetate
Also Known As: BAS 03787023, 3-((3-methyl-4-(thiophene-2-carboxamido)phenyl)carbamoyl)phenyl acetate, 3-({3-methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate
| Molecular Formula | C21H18N2O4S |
|---|---|
| Molecular Weight | 394.10 g/mol |
| LogP | 4.48642 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.09872 |
| Heavy Atoms | 28 |
| Complexity | 1028.6447 |
Chemical Identifiers
| CAS Number | 724747-48-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)NC(=O)C2=CC(=CC=C2)OC(=O)C)NC(=O)C3=CC=CS3 |
Product Overview
3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate (CAS 724747-48-2), with molecular formula C21H18N2O4S and molecular weight 394.10 g/mol. IUPAC: [3-[[3-methyl-4-(thiophene-2-carbonylamino)phenyl]carbamoyl]phenyl] acetate.
Chemical Property Profile of 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate
Property Insights of 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate
The XLogP value of 4.48642 indicates that 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate. Following Lipinski's Rule of Five, 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate has 2 hydrogen bond donor(s) and 5 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 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate?
The CAS number of 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate is 724747-48-2.
What is the molecular formula of 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate?
The molecular formula of 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate is C21H18N2O4S.
What is the molecular weight of 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate?
The molecular weight of 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate is 394.10 g/mol.
Where can I buy 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate?
You can request a quote for 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-({3-Methyl-4-[(thiophen-2-ylcarbonyl)amino]phenyl}carbamoyl)phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.