N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide
TL;DR: N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide (CAS 391228-70-9) is a chemical compound with molecular formula C14H14N4O5S and molecular weight 350.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide
Also Known As: N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide, N-(4-(tert-butyl)thiazol-2-yl)-2,4-dinitrobenzamide, F0193-0263
| Molecular Formula | C14H14N4O5S |
|---|---|
| Molecular Weight | 350.07 g/mol |
| LogP | 3.5093 |
| Topological Polar Surface Area | 128.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.06848 |
| Heavy Atoms | 24 |
| Complexity | 824.81256 |
Chemical Identifiers
| CAS Number | 391228-70-9 |
|---|---|
| SMILES | CC(C)(C)C1=CSC(=N1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide (CAS 391228-70-9), with molecular formula C14H14N4O5S and molecular weight 350.07 g/mol. IUPAC: N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide.
Chemical Property Profile of N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide
Property Insights of N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide
The XLogP value of 3.5093 indicates that N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.27 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide. Following Lipinski's Rule of Five, N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide has 1 hydrogen bond donor(s) and 7 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-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide?
The CAS number of N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide is 391228-70-9.
What is the molecular formula of N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide?
The molecular formula of N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide is C14H14N4O5S.
What is the molecular weight of N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide?
The molecular weight of N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide is 350.07 g/mol.
Where can I buy N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide?
You can request a quote for N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.