3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide
TL;DR: 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide (CAS 896357-18-9) is a chemical compound with molecular formula C17H13N3O3S2 and molecular weight 371.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylsulfanyl-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide
Also Known As: F2554-0068, 3-(methylsulfanyl)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide, 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide, 3-methylsulfanyl-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide, N-[4-(p-nitrophenyl)-1,3-thiazol-2-yl]m-(methylthio)benzamide
| Molecular Formula | C17H13N3O3S2 |
|---|---|
| Molecular Weight | 371.04 g/mol |
| LogP | 4.6925 |
| Topological Polar Surface Area | 85.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.03983 |
| Heavy Atoms | 25 |
| Complexity | 922.89734 |
Chemical Identifiers
| CAS Number | 896357-18-9 |
|---|---|
| SMILES | CSC1=CC=CC(=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide (CAS 896357-18-9), with molecular formula C17H13N3O3S2 and molecular weight 371.04 g/mol. IUPAC: 3-methylsulfanyl-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide.
Chemical Property Profile of 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide
Property Insights of 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide
The XLogP value of 4.6925 indicates that 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide. Following Lipinski's Rule of Five, 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide has 1 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 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide?
The CAS number of 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide is 896357-18-9.
What is the molecular formula of 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide?
The molecular formula of 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide is C17H13N3O3S2.
What is the molecular weight of 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide?
The molecular weight of 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide is 371.04 g/mol.
Where can I buy 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide?
You can request a quote for 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(methylthio)-N-(4-(4-nitrophenyl)thiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.