![4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide structure](/static/products/866/866014-38-2.png)
4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide
TL;DR: 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide (CAS 866014-38-2) is a chemical compound with molecular formula C13H9BrClN3OS and molecular weight 368.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[(2-chloro-3-pyridinyl)carbamothioyl]benzamide
Also Known As: 1-(4-BROMOBENZOYL)-3-(2-CHLOROPYRIDIN-3-YL)THIOUREA, 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide, 4-bromo-N-((2-chloropyridin-3-yl)carbamothioyl)benzamide, F1601-0463
| Molecular Formula | C13H9BrClN3OS |
|---|---|
| Molecular Weight | 368.93 g/mol |
| LogP | 3.6243 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 368.9338 |
| Heavy Atoms | 20 |
| Complexity | 648.31946 |
Chemical Identifiers
| CAS Number | 866014-38-2 |
|---|---|
| SMILES | C1=CC(=C(N=C1)Cl)NC(=S)NC(=O)C2=CC=C(C=C2)Br |
Product Overview
4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide (CAS 866014-38-2), with molecular formula C13H9BrClN3OS and molecular weight 368.93 g/mol. IUPAC: 4-bromo-N-[(2-chloro-3-pyridinyl)carbamothioyl]benzamide.
Chemical Property Profile of 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide
Property Insights of 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide
The XLogP value of 3.6243 indicates that 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide has 2 hydrogen bond donor(s) and 3 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-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide?
The CAS number of 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide is 866014-38-2.
What is the molecular formula of 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide?
The molecular formula of 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide is C13H9BrClN3OS.
What is the molecular weight of 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide?
The molecular weight of 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide is 368.93 g/mol.
Where can I buy 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide?
You can request a quote for 4-bromo-N-[(2-chloropyridin-3-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-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-[(2-chloropyridin-3-yl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.