2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine
TL;DR: 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine (CAS 347354-35-2) is a chemical compound with molecular formula C17H19N3O4S and molecular weight 361.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzenesulfonyl)-2-methyl-4-(4-nitrophenyl)piperazine
Also Known As: BAS 02252789, BIM-0002965.P001, 2-methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine, 1-(benzenesulfonyl)-2-methyl-4-(4-nitrophenyl)piperazine, 4-{4-nitrophenyl}-2-methyl-1-(phenylsulfonyl)piperazine
| Molecular Formula | C17H19N3O4S |
|---|---|
| Molecular Weight | 361.11 g/mol |
| LogP | 2.4942 |
| Topological Polar Surface Area | 83.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.10962 |
| Heavy Atoms | 25 |
| Complexity | 853.2215 |
Chemical Identifiers
| CAS Number | 347354-35-2 |
|---|---|
| SMILES | CC1CN(CCN1S(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine (CAS 347354-35-2), with molecular formula C17H19N3O4S and molecular weight 361.11 g/mol. IUPAC: 1-(benzenesulfonyl)-2-methyl-4-(4-nitrophenyl)piperazine.
Chemical Property Profile of 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine
Property Insights of 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine
The XLogP value of 2.4942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine. The TPSA of 83.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine. Following Lipinski's Rule of Five, 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine 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 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine?
The CAS number of 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine is 347354-35-2.
What is the molecular formula of 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine?
The molecular formula of 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine is C17H19N3O4S.
What is the molecular weight of 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine?
The molecular weight of 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine is 361.11 g/mol.
Where can I buy 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine?
You can request a quote for 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-4-(4-nitrophenyl)-1-(phenylsulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.