N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide
TL;DR: N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide (CAS 637301-45-2) is a chemical compound with molecular formula C19H15BrN4O4S2 and molecular weight 505.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-methyl-4-nitrobenzamide
Also Known As: N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide, N-[[4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-methyl-4-nitrobenzamide, N-{[4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl}-3-methyl-4-nitrobenzamide, N-[[4-(3-bromo-4-methoxy-phenyl)-1,3-thiazol-2-yl]thiocarbamoyl]-3-methyl-4-nitro-benzamide
| Molecular Formula | C19H15BrN4O4S2 |
|---|---|
| Molecular Weight | 505.97 g/mol |
| LogP | 4.92462 |
| Topological Polar Surface Area | 106.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 505.9718 |
| Heavy Atoms | 30 |
| Complexity | 1149.3131 |
Chemical Identifiers
| CAS Number | 637301-45-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC(=C(C=C3)OC)Br)[N+](=O)[O-] |
Product Overview
N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide (CAS 637301-45-2), with molecular formula C19H15BrN4O4S2 and molecular weight 505.97 g/mol. IUPAC: N-[[4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-methyl-4-nitrobenzamide.
Chemical Property Profile of N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide
Property Insights of N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide
The XLogP value of 4.92462 indicates that N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide 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 N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide. Following Lipinski's Rule of Five, N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide?
The CAS number of N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide is 637301-45-2.
What is the molecular formula of N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide?
The molecular formula of N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide is C19H15BrN4O4S2.
What is the molecular weight of N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide?
The molecular weight of N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide is 505.97 g/mol.
Where can I buy N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide?
You can request a quote for N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-((4-(3-bromo-4-methoxyphenyl)thiazol-2-yl)carbamothioyl)-3-methyl-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.