1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine
TL;DR: 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine (CAS 840518-46-9) is a chemical compound with molecular formula C19H20N4O2S and molecular weight 368.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylsulfonylpiperazin-1-yl)-4-phenylphthalazine
Also Known As: BAS 07007965, 1-(4-methylsulfonylpiperazin-1-yl)-4-phenylphthalazine, 1-(4-(methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine, 1-(4-Methanesulfonyl-piperazin-1-yl)-4-phenyl-phthalazine, 1-[4-(methylsulfonyl)piperazin-1-yl]-4-phenylphthalazine
| Molecular Formula | C19H20N4O2S |
|---|---|
| Molecular Weight | 368.13 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 368.1307 |
| Heavy Atoms | 26 |
| Complexity | 565.0 |
Chemical Identifiers
| CAS Number | 840518-46-9 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)C2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4 |
| InChIKey | GSHZPLGBKGTIOR-UHFFFAOYSA-N |
Product Overview
1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine (CAS 840518-46-9), with molecular formula C19H20N4O2S and molecular weight 368.13 g/mol. IUPAC: 1-(4-methylsulfonylpiperazin-1-yl)-4-phenylphthalazine.
Chemical Property Profile of 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine
Property Insights of 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine. Following Lipinski's Rule of Five, 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine has 0 hydrogen bond donor(s) and 6 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-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine?
The CAS number of 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine is 840518-46-9.
What is the molecular formula of 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine?
The molecular formula of 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine is C19H20N4O2S.
What is the molecular weight of 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine?
The molecular weight of 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine is 368.13 g/mol.
Where can I buy 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine?
You can request a quote for 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-(Methylsulfonyl)piperazin-1-yl)-4-phenylphthalazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.