![5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide structure](/static/products/4585/458535-63-2.webp)
5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide
TL;DR: 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide (CAS 458535-63-2) is a chemical compound with molecular formula C21H19N3O5S and molecular weight 425.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide
Also Known As: 5-benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide, 5-benzyl-4-methyl-2-{[(4-nitrophenoxy)acetyl]amino}-3-thiophenecarboxamide, 4-methyl-2-[2-(4-nitrophenoxy)acetylamino]-5-benzylthiophene-3-carboxamide, 5-benzyl-4-methyl-2-{[(4-nitrophenoxy)acetyl]amino}thiophene-3-carboxamide
| Molecular Formula | C21H19N3O5S |
|---|---|
| Molecular Weight | 425.10 g/mol |
| LogP | 3.67192 |
| Topological Polar Surface Area | 124.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 425.10455 |
| Heavy Atoms | 30 |
| Complexity | 1078.0262 |
Chemical Identifiers
| CAS Number | 458535-63-2 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)N)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3 |
Product Overview
5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide (CAS 458535-63-2), with molecular formula C21H19N3O5S and molecular weight 425.10 g/mol. IUPAC: 5-benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide.
Chemical Property Profile of 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide
Property Insights of 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide
The XLogP value of 3.67192 indicates that 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide. Following Lipinski's Rule of Five, 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide 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 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide?
The CAS number of 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide is 458535-63-2.
What is the molecular formula of 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide?
The molecular formula of 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide is C21H19N3O5S.
What is the molecular weight of 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide?
The molecular weight of 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide is 425.10 g/mol.
Where can I buy 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide?
You can request a quote for 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzyl-4-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.