N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide
TL;DR: N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide (CAS 428458-04-2) is a chemical compound with molecular formula C17H11BrFN3OS2 and molecular weight 434.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide
Also Known As: N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide, N-((4-(4-bromophenyl)thiazol-2-yl)carbamothioyl)-3-fluorobenzamide, N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]thiocarbamoyl]-3-fluoro-benzamide, N-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl}-3-fluorobenzamide, N-({[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}carbonothioyl)-3-fluorobenzamide
| Molecular Formula | C17H11BrFN3OS2 |
|---|---|
| Molecular Weight | 434.95 g/mol |
| LogP | 4.8385 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 434.9511 |
| Heavy Atoms | 25 |
| Complexity | 927.6522 |
Chemical Identifiers
| CAS Number | 428458-04-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)Br |
Product Overview
N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide (CAS 428458-04-2), with molecular formula C17H11BrFN3OS2 and molecular weight 434.95 g/mol. IUPAC: N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide.
Chemical Property Profile of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide
Property Insights of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide
The XLogP value of 4.8385 indicates that N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide has 2 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-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide?
The CAS number of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide is 428458-04-2.
What is the molecular formula of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide?
The molecular formula of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide is C17H11BrFN3OS2.
What is the molecular weight of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide?
The molecular weight of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide is 434.95 g/mol.
Where can I buy N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide?
You can request a quote for N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide 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-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.