1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine
TL;DR: 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine (CAS 840518-07-2) is a chemical compound with molecular formula C25H24N4O2S and molecular weight 444.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(benzenesulfonyl)piperazin-1-yl]-4-(4-methylphenyl)phthalazine
Also Known As: 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine, 1-(4-methylphenyl)-4-[4-(phenylsulfonyl)piperazin-1-yl]phthalazine, 1-[4-(benzenesulfonyl)piperazin-1-yl]-4-(4-methylphenyl)phthalazine
| Molecular Formula | C25H24N4O2S |
|---|---|
| Molecular Weight | 444.16 g/mol |
| LogP | 4.11612 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.162 |
| Heavy Atoms | 32 |
| Complexity | 1348.1134 |
Chemical Identifiers
| CAS Number | 840518-07-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)S(=O)(=O)C5=CC=CC=C5 |
Product Overview
1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine (CAS 840518-07-2), with molecular formula C25H24N4O2S and molecular weight 444.16 g/mol. IUPAC: 1-[4-(benzenesulfonyl)piperazin-1-yl]-4-(4-methylphenyl)phthalazine.
Chemical Property Profile of 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine
Property Insights of 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine
The XLogP value of 4.11612 indicates that 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine. Following Lipinski's Rule of Five, 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine has 0 hydrogen bond donor(s) and 5 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 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine?
The CAS number of 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine is 840518-07-2.
What is the molecular formula of 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine?
The molecular formula of 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine is C25H24N4O2S.
What is the molecular weight of 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine?
The molecular weight of 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine is 444.16 g/mol.
Where can I buy 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine?
You can request a quote for 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-(Phenylsulfonyl)piperazin-1-yl)-4-(p-tolyl)phthalazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.