2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one
TL;DR: 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one (CAS 591735-70-5) is a chemical compound with molecular formula C20H11Cl2N3O3 and molecular weight 411.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1-one
Also Known As: 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one, 2-(2-chloro-5-nitro-phenyl)-4-(4-chlorophenyl)phthalazin-1-one, 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1-one
| Molecular Formula | C20H11Cl2N3O3 |
|---|---|
| Molecular Weight | 411.02 g/mol |
| LogP | 5.2677 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 411.01776 |
| Heavy Atoms | 28 |
| Complexity | 1284.3618 |
Chemical Identifiers
| CAS Number | 591735-70-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NN(C2=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C4=CC=C(C=C4)Cl |
Product Overview
2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one (CAS 591735-70-5), with molecular formula C20H11Cl2N3O3 and molecular weight 411.02 g/mol. IUPAC: 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1-one.
Chemical Property Profile of 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one
Property Insights of 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one
The XLogP value of 5.2677 indicates that 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one. Following Lipinski's Rule of Five, 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one?
The CAS number of 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one is 591735-70-5.
What is the molecular formula of 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one?
The molecular formula of 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one is C20H11Cl2N3O3.
What is the molecular weight of 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one?
The molecular weight of 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one is 411.02 g/mol.
Where can I buy 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one?
You can request a quote for 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-chloro-5-nitrophenyl)-4-(4-chlorophenyl)phthalazin-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.