1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine
TL;DR: 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine (CAS 432534-72-0) is a chemical compound with molecular formula C22H28N4O4S and molecular weight 444.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine
Also Known As: A3045/0128555, 1-(benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine, 2-methyl-4-[4-nitro-3-(piperidin-1-yl)phenyl]-1-(phenylsulfonyl)piperazine, 1-(BENZENESULFONYL)-2-METHYL-4-[4-NITRO-3-(PIPERIDIN-1-YL)PHENYL]PIPERAZINE
| Molecular Formula | C22H28N4O4S |
|---|---|
| Molecular Weight | 444.18 g/mol |
| LogP | 3.4845 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 444.18314 |
| Heavy Atoms | 31 |
| Complexity | 1038.7313 |
Chemical Identifiers
| CAS Number | 432534-72-0 |
|---|---|
| SMILES | CC1CN(CCN1S(=O)(=O)C2=CC=CC=C2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCCCC4 |
Product Overview
1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine (CAS 432534-72-0), with molecular formula C22H28N4O4S and molecular weight 444.18 g/mol. IUPAC: 1-(benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine.
Chemical Property Profile of 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine
Property Insights of 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine
The XLogP value of 3.4845 indicates that 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine. Following Lipinski's Rule of Five, 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine 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-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine?
The CAS number of 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine is 432534-72-0.
What is the molecular formula of 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine?
The molecular formula of 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine is C22H28N4O4S.
What is the molecular weight of 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine?
The molecular weight of 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine is 444.18 g/mol.
Where can I buy 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine?
You can request a quote for 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzenesulfonyl)-2-methyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.