1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone
TL;DR: 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone (CAS 461413-52-5) is a chemical compound with molecular formula C19H22N2O3S and molecular weight 358.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone
Also Known As: BAS 04057139, 1-(diphenylacetyl)-4-(methylsulfonyl)piperazine, 1-(4-methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone, AT-057/43316509, 1-[4-(methylsulfonyl)piperazin-1-yl]-2,2-diphenylethanone
| Molecular Formula | C19H22N2O3S |
|---|---|
| Molecular Weight | 358.14 g/mol |
| LogP | 1.9223 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.1351 |
| Heavy Atoms | 25 |
| Complexity | 774.7624 |
Chemical Identifiers
| CAS Number | 461413-52-5 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone (CAS 461413-52-5), with molecular formula C19H22N2O3S and molecular weight 358.14 g/mol. IUPAC: 1-(4-methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone.
Chemical Property Profile of 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone
Property Insights of 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone
The XLogP value of 1.9223 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone. With a topological polar surface area (TPSA) of 57.69 Ų, 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone has 0 hydrogen bond donor(s) and 3 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-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone?
The CAS number of 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone is 461413-52-5.
What is the molecular formula of 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone?
The molecular formula of 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone is C19H22N2O3S.
What is the molecular weight of 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone?
The molecular weight of 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone is 358.14 g/mol.
Where can I buy 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone?
You can request a quote for 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylsulfonylpiperazin-1-yl)-2,2-diphenylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.