N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide
TL;DR: N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide (CAS 851079-63-5) is a chemical compound with molecular formula C21H22N4O3S and molecular weight 410.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-butylphenyl)-2-[1-(4-nitrophenyl)imidazol-2-yl]sulfanylacetamide
Also Known As: F0599-0564, N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide, N-(4-butylphenyl)-2-{[1-(4-nitrophenyl)-1H-imidazol-2-yl]sulfanyl}acetamide, N-(4-butylphenyl)-2-[1-(4-nitrophenyl)imidazol-2-yl]sulfanylacetamide
| Molecular Formula | C21H22N4O3S |
|---|---|
| Molecular Weight | 410.14 g/mol |
| LogP | 4.8539 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 410.14127 |
| Heavy Atoms | 29 |
| Complexity | 968.3511 |
Chemical Identifiers
| CAS Number | 851079-63-5 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC=CN2C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide (CAS 851079-63-5), with molecular formula C21H22N4O3S and molecular weight 410.14 g/mol. IUPAC: N-(4-butylphenyl)-2-[1-(4-nitrophenyl)imidazol-2-yl]sulfanylacetamide.
Chemical Property Profile of N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide
Property Insights of N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide
The XLogP value of 4.8539 indicates that N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide. Following Lipinski's Rule of Five, N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide has 1 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 N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide?
The CAS number of N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide is 851079-63-5.
What is the molecular formula of N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide?
The molecular formula of N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide is C21H22N4O3S.
What is the molecular weight of N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide?
The molecular weight of N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide is 410.14 g/mol.
Where can I buy N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide?
You can request a quote for N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-butylphenyl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.