![methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate structure](/static/products/4449/444923-89-1.webp)
methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate
TL;DR: methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate (CAS 444923-89-1) is a chemical compound with molecular formula C24H24N2O5S and molecular weight 452.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate
Also Known As: methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate, methyl 4-(4-sec-butylphenyl)-2-[({4-nitrophenyl}acetyl)amino]-3-thiophenecarboxylate, methyl 4-(4-(sec-butyl)phenyl)-2-(2-(4-nitrophenyl)acetamido)thiophene-3-carboxylate, methyl 4-[4-(butan-2-yl)phenyl]-2-{[(4-nitrophenyl)acetyl]amino}thiophene-3-carboxylate, METHYL 4-[4-(SEC-BUTYL)PHENYL]-2-{[2-(4-NITROPHENYL)ACETYL]AMINO}-3-THIOPHENECARBOXYLATE
| Molecular Formula | C24H24N2O5S |
|---|---|
| Molecular Weight | 452.14 g/mol |
| LogP | 5.8046 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 452.1406 |
| Heavy Atoms | 32 |
| Complexity | 1120.2963 |
Chemical Identifiers
| CAS Number | 444923-89-1 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CC3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate (CAS 444923-89-1), with molecular formula C24H24N2O5S and molecular weight 452.14 g/mol. IUPAC: methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate
Property Insights of methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate
The XLogP value of 5.8046 indicates that methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate?
The CAS number of methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate is 444923-89-1.
What is the molecular formula of methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate?
The molecular formula of methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate is C24H24N2O5S.
What is the molecular weight of methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate?
The molecular weight of methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate is 452.14 g/mol.
Where can I buy methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate?
You can request a quote for methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-(4-butan-2-ylphenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.