![N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide structure](/static/products/4454/445418-08-6.webp)
N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide
TL;DR: N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide (CAS 445418-08-6) is a chemical compound with molecular formula C18H13BrClN3OS2 and molecular weight 464.94 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]-2-chloro-4-methylbenzamide
Also Known As: AN-465/41163504, N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide, N-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl}-2-chloro-4-methylbenzamide, N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-N'-(2-chloro-4-methylbenzoyl)thiourea
| Molecular Formula | C18H13BrClN3OS2 |
|---|---|
| Molecular Weight | 464.94 g/mol |
| LogP | 5.66122 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 464.9372 |
| Heavy Atoms | 26 |
| Complexity | 972.8225 |
Chemical Identifiers
| CAS Number | 445418-08-6 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)Br)Cl |
Product Overview
N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide (CAS 445418-08-6), with molecular formula C18H13BrClN3OS2 and molecular weight 464.94 g/mol. IUPAC: N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide.
Chemical Property Profile of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide
Property Insights of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide
The XLogP value of 5.66122 indicates that N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide 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]-2-chloro-4-methylbenzamide 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]-2-chloro-4-methylbenzamide has 2 hydrogen bond donor(s) and 4 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-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide?
The CAS number of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide is 445418-08-6.
What is the molecular formula of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide?
The molecular formula of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide is C18H13BrClN3OS2.
What is the molecular weight of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide?
The molecular weight of N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide is 464.94 g/mol.
Where can I buy N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide?
You can request a quote for N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide 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]-2-chloro-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-chloro-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.