![4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide structure](/static/products/3337/333739-08-5.webp)
4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide
TL;DR: 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide (CAS 333739-08-5) is a chemical compound with molecular formula C18H14N4O4S2 and molecular weight 414.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide
Also Known As: BAS 02819902, 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide, 1-(4-Methoxy-3-nitro-benzoyl)-3-(4-phenyl-thiazol-2-yl)-thiourea, N-{3-nitro-4-methoxybenzoyl}-N'-(4-phenyl-1,3-thiazol-2-yl)thiourea, (4-methoxy-3-nitrophenyl)-N-{[(4-phenyl(1,3-thiazol-2-yl))amino]thioxomethyl}c arboxamide
| Molecular Formula | C18H14N4O4S2 |
|---|---|
| Molecular Weight | 414.05 g/mol |
| LogP | 3.8537 |
| Topological Polar Surface Area | 106.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.04565 |
| Heavy Atoms | 28 |
| Complexity | 1037.0747 |
Chemical Identifiers
| CAS Number | 333739-08-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=CC=C3)[N+](=O)[O-] |
Product Overview
4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide (CAS 333739-08-5), with molecular formula C18H14N4O4S2 and molecular weight 414.05 g/mol. IUPAC: 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide.
Chemical Property Profile of 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide
Property Insights of 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide
The XLogP value of 3.8537 indicates that 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide. Following Lipinski's Rule of Five, 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide has 2 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 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide?
The CAS number of 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide is 333739-08-5.
What is the molecular formula of 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide?
The molecular formula of 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide is C18H14N4O4S2.
What is the molecular weight of 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide?
The molecular weight of 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide is 414.05 g/mol.
Where can I buy 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide?
You can request a quote for 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.