4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide
TL;DR: 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide (CAS 5861-34-7) 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.
4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide
Also Known As: BAS 01119516, BIM-0035446.P001, 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide, 4-methyl-3-nitro-N-[4-(1-piperidinyl)phenyl]benzenesulfonamide, 4-METHYL-3-NITRO-N-[4-(PIPERIDIN-1-YL)PHENYL]BENZENE-1-SULFONAMIDE
| Molecular Formula | C18H21N3O4S |
|---|---|
| Molecular Weight | 375.13 g/mol |
| LogP | 3.69432 |
| Topological Polar Surface Area | 92.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.12527 |
| Heavy Atoms | 26 |
| Complexity | 904.5335 |
Chemical Identifiers
| CAS Number | 5861-34-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3CCCCC3)[N+](=O)[O-] |
Product Overview
4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide (CAS 5861-34-7), with molecular formula C18H21N3O4S and molecular weight 375.13 g/mol. IUPAC: 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide.
Chemical Property Profile of 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide
Property Insights of 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide
The XLogP value of 3.69432 indicates that 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide 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 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide?
The CAS number of 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide is 5861-34-7.
What is the molecular formula of 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide?
The molecular formula of 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide is C18H21N3O4S.
What is the molecular weight of 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide?
The molecular weight of 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide is 375.13 g/mol.
Where can I buy 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide?
You can request a quote for 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-3-nitro-N-(4-piperidin-1-ylphenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.