![N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide structure](/static/products/5460/546090-53-3.webp)
N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide
TL;DR: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide (CAS 546090-53-3) is a chemical compound with molecular formula C16H17N3OS and molecular weight 299.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide
Also Known As: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide, N-[4-(4-tert-butylphenyl)thiazol-2-yl]-2-cyano-acetamide
| Molecular Formula | C16H17N3OS |
|---|---|
| Molecular Weight | 299.11 g/mol |
| LogP | 3.95978 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.10922 |
| Heavy Atoms | 21 |
| Complexity | 674.783 |
Chemical Identifiers
| CAS Number | 546090-53-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CC#N |
Product Overview
N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide (CAS 546090-53-3), with molecular formula C16H17N3OS and molecular weight 299.11 g/mol. IUPAC: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide.
Chemical Property Profile of N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide
Property Insights of N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide
The XLogP value of 3.95978 indicates that N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide. Following Lipinski's Rule of Five, N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide has 1 hydrogen bond donor(s) and 4 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-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide?
The CAS number of N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide is 546090-53-3.
What is the molecular formula of N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide?
The molecular formula of N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide is C16H17N3OS.
What is the molecular weight of N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide?
The molecular weight of N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide is 299.11 g/mol.
Where can I buy N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide?
You can request a quote for N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-cyanoacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.