(2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone
TL;DR: (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone (CAS 428847-54-5) is a chemical compound with molecular formula C12H15ClN2O3S and molecular weight 302.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone
Also Known As: BAS 03153080, (2-chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone, 2-chlorophenyl 4-(methylsulfonyl)piperazinyl ketone, (2-chlorophenyl)[4-(methylsulfonyl)piperazin-1-yl]methanone, 1-(2-CHLOROBENZOYL)-4-METHANESULFONYLPIPERAZINE
| Molecular Formula | C12H15ClN2O3S |
|---|---|
| Molecular Weight | 302.05 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 302.0492 |
| Heavy Atoms | 19 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 428847-54-5 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2Cl |
| InChIKey | IALVTCTYRJLQRI-UHFFFAOYSA-N |
Product Overview
(2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone (CAS 428847-54-5), with molecular formula C12H15ClN2O3S and molecular weight 302.05 g/mol. IUPAC: (2-chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone.
Chemical Property Profile of (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone
Property Insights of (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone. Following Lipinski's Rule of Five, (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone has 0 hydrogen bond donor(s) and 4 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 (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone?
The CAS number of (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone is 428847-54-5.
What is the molecular formula of (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone?
The molecular formula of (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone is C12H15ClN2O3S.
What is the molecular weight of (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone?
The molecular weight of (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone is 302.05 g/mol.
Where can I buy (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone?
You can request a quote for (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (2-Chlorophenyl)-(4-methylsulfonylpiperazin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.