![5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline structure](/static/products/5240/524034-07-9.webp)
5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline
TL;DR: 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline (CAS 524034-07-9) is a chemical compound with molecular formula C21H26N4O5S and molecular weight 446.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline
Also Known As: 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline, 2-nitro-5-[4-(phenylsulfonyl)-1-piperazinyl]-N-(tetrahydro-2-furanylmethyl)aniline, 2-nitro-5-[4-(phenylsulfonyl)piperazin-1-yl]-N-(tetrahydrofuran-2-ylmethyl)aniline, Cambridge id 7269941
| Molecular Formula | C21H26N4O5S |
|---|---|
| Molecular Weight | 446.16 g/mol |
| LogP | 2.6966 |
| Topological Polar Surface Area | 105.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 446.16238 |
| Heavy Atoms | 31 |
| Complexity | 1017.32056 |
Chemical Identifiers
| CAS Number | 524034-07-9 |
|---|---|
| SMILES | C1CC(OC1)CNC2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)[N+](=O)[O-] |
Product Overview
5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline (CAS 524034-07-9), with molecular formula C21H26N4O5S and molecular weight 446.16 g/mol. IUPAC: 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline.
Chemical Property Profile of 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline
Property Insights of 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline
The XLogP value of 2.6966 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline. The TPSA of 105.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline. Following Lipinski's Rule of Five, 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline has 1 hydrogen bond donor(s) and 7 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 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline?
The CAS number of 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline is 524034-07-9.
What is the molecular formula of 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline?
The molecular formula of 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline is C21H26N4O5S.
What is the molecular weight of 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline?
The molecular weight of 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline is 446.16 g/mol.
Where can I buy 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline?
You can request a quote for 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(oxolan-2-ylmethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.