4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide
TL;DR: 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide (CAS 371212-87-2) is a chemical compound with molecular formula C27H33N3O5S and molecular weight 511.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-hydroxy-[2-(4-methylphenyl)-4,5-dioxo-1-(2-piperidin-1-ylethyl)pyrrolidin-3-ylidene]methyl]-N,N-dimethylbenzenesulfonamide
Also Known As: 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide, 4-(4-hydroxy-5-oxo-1-(2-(piperidin-1-yl)ethyl)-2-(p-tolyl)-2,5-dihydro-1H-pyrrole-3-carbonyl)-N,N-dimethylbenzenesulfonamide, 4-[(E)-hydroxy-[2-(4-methylphenyl)-4,5-dioxo-1-(2-piperidin-1-ylethyl)pyrrolidin-3-ylidene]methyl]-N,N-dimethylbenzenesulfonamide
| Molecular Formula | C27H33N3O5S |
|---|---|
| Molecular Weight | 511.21 g/mol |
| LogP | 3.15292 |
| Topological Polar Surface Area | 98.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 511.21408 |
| Heavy Atoms | 36 |
| Complexity | 1261.4923 |
Chemical Identifiers
| CAS Number | 371212-87-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)S(=O)(=O)N(C)C)\O)/C(=O)C(=O)N2CCN4CCCCC4 |
Product Overview
4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide (CAS 371212-87-2), with molecular formula C27H33N3O5S and molecular weight 511.21 g/mol. IUPAC: 4-[(E)-hydroxy-[2-(4-methylphenyl)-4,5-dioxo-1-(2-piperidin-1-ylethyl)pyrrolidin-3-ylidene]methyl]-N,N-dimethylbenzenesulfonamide.
Chemical Property Profile of 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide
Property Insights of 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide
The XLogP value of 3.15292 indicates that 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide. Following Lipinski's Rule of Five, 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide?
The CAS number of 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide is 371212-87-2.
What is the molecular formula of 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide?
The molecular formula of 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide is C27H33N3O5S.
What is the molecular weight of 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide?
The molecular weight of 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide is 511.21 g/mol.
Where can I buy 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide?
You can request a quote for 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-({4-hydroxy-2-(4-methylphenyl)-5-oxo-1-[2-(piperidin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-N,N-dimethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.