1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea
TL;DR: 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea (CAS 219793-76-7) is a chemical compound with molecular formula C16H10Br3ClN4O and molecular weight 545.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea
Also Known As: 1-(4-chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea, Urea, N-(4-chlorophenyl)-N'-[4-(3,4,5-tribromo-1H-pyrazol-1-yl)phenyl]-, 1-(4-chlorophenyl)-3-[4-(tribromopyrazol-1-yl)phenyl]urea, N-(4-chlorophenyl)-N'-[4-(3,4,5-tribromo-1H-pyrazol-1-yl)phenyl]urea, 2-Propenoic acid,2-cyano-3-[[4-(3,4,5-tribromo-1H-pyrazol-1-yl)phenyl]amino]-,ethyl ester
| Molecular Formula | C16H10Br3ClN4O |
|---|---|
| Molecular Weight | 545.81 g/mol |
| LogP | 6.4572 |
| Topological Polar Surface Area | 58.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 545.8093 |
| Heavy Atoms | 25 |
| Complexity | 910.37933 |
Chemical Identifiers
| CAS Number | 219793-76-7 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)Cl)N3C(=C(C(=N3)Br)Br)Br |
Product Overview
1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea (CAS 219793-76-7), with molecular formula C16H10Br3ClN4O and molecular weight 545.81 g/mol. IUPAC: 1-(4-chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea.
Chemical Property Profile of 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea
Property Insights of 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea
The XLogP value of 6.4572 indicates that 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.95 Ų, 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea has 2 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 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea?
The CAS number of 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea is 219793-76-7.
What is the molecular formula of 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea?
The molecular formula of 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea is C16H10Br3ClN4O.
What is the molecular weight of 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea?
The molecular weight of 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea is 545.81 g/mol.
Where can I buy 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea?
You can request a quote for 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-3-[4-(3,4,5-tribromopyrazol-1-yl)phenyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.