N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea
TL;DR: N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea (CAS 646989-61-9) is a chemical compound with molecular formula C9H4BrCl3F2N2O and molecular weight 377.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromo-2,6-difluorophenyl)-3-(1,2,2-trichloroethenyl)urea
Also Known As: N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea, 1-(4-bromo-2,6-difluorophenyl)-3-(1,2,2-trichloroethenyl)urea, 1-(4-bromo-2,6-difluorophenyl)-3-(trichloroethenyl)urea
| Molecular Formula | C9H4BrCl3F2N2O |
|---|---|
| Molecular Weight | 377.85 g/mol |
| LogP | 4.6918 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 377.85406 |
| Heavy Atoms | 18 |
| Complexity | 497.52936 |
Chemical Identifiers
| CAS Number | 646989-61-9 |
|---|---|
| SMILES | C1=C(C=C(C(=C1F)NC(=O)NC(=C(Cl)Cl)Cl)F)Br |
Product Overview
N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea (CAS 646989-61-9), with molecular formula C9H4BrCl3F2N2O and molecular weight 377.85 g/mol. IUPAC: 1-(4-bromo-2,6-difluorophenyl)-3-(1,2,2-trichloroethenyl)urea.
Chemical Property Profile of N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea
Property Insights of N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea
The XLogP value of 4.6918 indicates that N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea has 2 hydrogen bond donor(s) and 1 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-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea?
The CAS number of N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea is 646989-61-9.
What is the molecular formula of N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea?
The molecular formula of N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea is C9H4BrCl3F2N2O.
What is the molecular weight of N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea?
The molecular weight of N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea is 377.85 g/mol.
Where can I buy N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea?
You can request a quote for N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromo-2,6-difluorophenyl)-N'-(1,2,2-trichlorovinyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.