1-(3-Bromophenylsulfonyl)-4-ethylpiperazine
TL;DR: 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine (CAS 1004636-96-7) is a chemical compound with molecular formula C12H17BrN2O2S and molecular weight 332.0194 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-bromophenyl)sulfonyl-4-ethylpiperazine
Also Known As: 1-(3-bromophenylsulfonyl)-4-ethylpiperazine, 1-(3-bromophenyl)sulfonyl-4-ethylpiperazine, 1-((3-bromophenyl)sulfonyl)-4-ethylpiperazine, 1-(3-bromophenyl)sulfonyl-4-ethyl-piperazine, 1-(3-BROMOBENZENESULFONYL)-4-ETHYLPIPERAZINE
Technical Specifications
| Molecular Formula | C12H17BrN2O2S |
| Molecular Weight | 332.0194 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 49.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.0194 Da |
| Heavy Atoms | 18 |
| Complexity | 361.0 |
| SMILES | CCN1CCN(CC1)S(=O)(=O)C2=CC(=CC=C2)Br |
| InChIKey | AMVGOMHHEHTLRD-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine
Property Insights of 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine. With a topological polar surface area (TPSA) of 49.0 Ų, 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine 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
What is the CAS number of 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine?
The CAS number of 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine is 1004636-96-7.
What is the molecular formula of 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine?
The molecular formula of 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine is C12H17BrN2O2S.
What is the molecular weight of 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine?
The molecular weight of 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine is 332.0194 g/mol.
Where can I buy 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine?
You can request a quote for 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine?
Yes, CoreyChem provides custom synthesis services for 1-(3-Bromophenylsulfonyl)-4-ethylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.