2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide
TL;DR: 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide (CAS 303046-36-8) is a chemical compound with molecular formula C16H12Br2Cl3N3OS and molecular weight 556.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-[1-[(3-bromophenyl)carbamothioylamino]-2,2,2-trichloroethyl]benzamide
Also Known As: 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide, 2-bromo-N-[1-[(3-bromophenyl)carbamothioylamino]-2,2,2-trichloroethyl]benzamide, 2-bromo-N-[1-[(3-bromophenyl)thiocarbamoylamino]-2,2,2-trichloro-ethyl]benzamide
| Molecular Formula | C16H12Br2Cl3N3OS |
|---|---|
| Molecular Weight | 556.81 g/mol |
| LogP | 5.6243 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 556.81335 |
| Heavy Atoms | 26 |
| Complexity | 817.32214 |
Chemical Identifiers
| CAS Number | 303046-36-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC(=CC=C2)Br)Br |
Product Overview
2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide (CAS 303046-36-8), with molecular formula C16H12Br2Cl3N3OS and molecular weight 556.81 g/mol. IUPAC: 2-bromo-N-[1-[(3-bromophenyl)carbamothioylamino]-2,2,2-trichloroethyl]benzamide.
Chemical Property Profile of 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide
Property Insights of 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide
The XLogP value of 5.6243 indicates that 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.16 Ų, 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide?
The CAS number of 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide is 303046-36-8.
What is the molecular formula of 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide?
The molecular formula of 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide is C16H12Br2Cl3N3OS.
What is the molecular weight of 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide?
The molecular weight of 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide is 556.81 g/mol.
Where can I buy 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide?
You can request a quote for 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-N-(1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.