[2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate
TL;DR: [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate (CAS 370586-69-9) is a chemical compound with molecular formula C21H20N2O4S2 and molecular weight 428.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate
Also Known As: [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate|(E)-2-((4-oxo-2-(piperidin-1-yl)thiazol-5(4H)-ylidene)methyl)phenyl benzenesulfonate|2-{(E)-[4-oxo-2-(piperidin-1-yl)-1,3-thiazol-5(4H)-ylidene]methyl}phenyl benzenesulfonate
| Molecular Formula | C21H20N2O4S2 |
|---|---|
| Molecular Weight | 428.09 g/mol |
| LogP | 3.9105 |
| Topological Polar Surface Area | 76.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.08646 |
| Heavy Atoms | 29 |
| Complexity | 1072.8698 |
Chemical Identifiers
| CAS Number | 370586-69-9 |
|---|---|
| SMILES | C1CCN(CC1)C2=NC(=O)/C(=C\C3=CC=CC=C3OS(=O)(=O)C4=CC=CC=C4)/S2 |
Product Overview
[2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate (CAS 370586-69-9), with molecular formula C21H20N2O4S2 and molecular weight 428.09 g/mol. IUPAC: [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate.
Chemical Property Profile of [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate
Property Insights of [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate
The XLogP value of 3.9105 indicates that [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.04 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate. Following Lipinski's Rule of Five, [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate 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 [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate?
The CAS number of [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate is 370586-69-9.
What is the molecular formula of [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate?
The molecular formula of [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate is C21H20N2O4S2.
What is the molecular weight of [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate?
The molecular weight of [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate is 428.09 g/mol.
Where can I buy [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate?
You can request a quote for [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for [2-[(E)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenyl] benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.