2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one
TL;DR: 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one (CAS 447430-67-3) is a chemical compound with molecular formula C20H12BrClN2O and molecular weight 409.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one
Also Known As: 2-(4-bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one, 5F-379S, 2-(4-bromophenyl)-4-(4-chlorophenyl)-1(2H)-phthalazinone, 2-(4-bromophenyl)-4-(4-chlorophenyl)-1,2-dihydrophthalazin-1-one
| Molecular Formula | C20H12BrClN2O |
|---|---|
| Molecular Weight | 409.98 g/mol |
| LogP | 5.4686 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 409.98215 |
| Heavy Atoms | 25 |
| Complexity | 1119.2101 |
Chemical Identifiers
| CAS Number | 447430-67-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Cl |
Product Overview
2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one (CAS 447430-67-3), with molecular formula C20H12BrClN2O and molecular weight 409.98 g/mol. IUPAC: 2-(4-bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one.
Chemical Property Profile of 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one
Property Insights of 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one
The XLogP value of 5.4686 indicates that 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one has 0 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-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one?
The CAS number of 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one is 447430-67-3.
What is the molecular formula of 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one?
The molecular formula of 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one is C20H12BrClN2O.
What is the molecular weight of 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one?
The molecular weight of 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one is 409.98 g/mol.
Where can I buy 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one?
You can request a quote for 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromophenyl)-4-(4-chlorophenyl)phthalazin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.