N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide
TL;DR: N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide (CAS 205058-89-5) is a chemical compound with molecular formula C18H21N3O4S and molecular weight 375.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide
Also Known As: N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide, N-(1-benzylpiperidin-4-yl)-2-nitrobenzene-1-sulfonamide, N-(1-benzyl-4-piperidinyl)-2-nitrobenzenesulfonamide, N-(1-benzyl-4-piperidyl)-2-nitro-benzenesulfonamide, 2-nitro-N-[1-(phenylmethyl)-4-piperidinyl]-benzenesulphonic acid amide
| Molecular Formula | C18H21N3O4S |
|---|---|
| Molecular Weight | 375.13 g/mol |
| LogP | 2.5377 |
| Topological Polar Surface Area | 92.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.12527 |
| Heavy Atoms | 26 |
| Complexity | 863.0148 |
Chemical Identifiers
| CAS Number | 205058-89-5 |
|---|---|
| SMILES | C1CN(CCC1NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])CC3=CC=CC=C3 |
Product Overview
N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide (CAS 205058-89-5), with molecular formula C18H21N3O4S and molecular weight 375.13 g/mol. IUPAC: N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide.
Chemical Property Profile of N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide
Property Insights of N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide
The XLogP value of 2.5377 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide. The TPSA of 92.55 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide has 1 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 N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide?
The CAS number of N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide is 205058-89-5.
What is the molecular formula of N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide?
The molecular formula of N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide is C18H21N3O4S.
What is the molecular weight of N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide?
The molecular weight of N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide is 375.13 g/mol.
Where can I buy N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide?
You can request a quote for N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-benzylpiperidin-4-yl)-2-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.