1-(4-Isothiocyanatophenylsulfonyl)piperidine
TL;DR: 1-(4-Isothiocyanatophenylsulfonyl)piperidine (CAS 7356-55-0) is a chemical compound with molecular formula C12H14N2O2S2 and molecular weight 282.04968 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-isothiocyanatophenyl)sulfonylpiperidine
Also Known As: 1-[(4-isothiocyanatophenyl)sulfonyl]piperidine, 1-(4-isothiocyanatophenyl)sulfonylpiperidine, Piperidine,1-[(4-isothiocyanatophenyl)sulfonyl]-, 1-(4-Hydroxyphenyl)ethanone, 1-(4-isothiocyanatobenzenesulfonyl)piperidine
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H14N2O2S2 |
| Molecular Weight | 282.04968 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 90.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.04968 Da |
| Heavy Atoms | 18 |
| Complexity | 410.0 |
| SMILES | C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N=C=S |
| InChIKey | PMPSZAXEUCIVDC-UHFFFAOYSA-N |
Product Description
Applications: 1-(4-Isothiocyanatophenylsulfonyl)piperidine is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1-(4-Isothiocyanatophenylsulfonyl)piperidine (CAS 7356-55-0) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A heterocyclic building block supplied by CoreyChem, 1-(4-Isothiocyanatophenylsulfonyl)piperidine (CAS 7356-55-0) has the molecular formula C12H14N2O2S2 and a molecular weight of 282.05 g/mol. It is also known as 1-[(4-isothiocyanatophenyl)sulfonyl]piperidine and 1-(4-isothiocyanatophenyl)sulfonylpiperidine.
CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 1-(4-Isothiocyanatophenylsulfonyl)piperidine
Property Insights of 1-(4-Isothiocyanatophenylsulfonyl)piperidine
The XLogP value of 3.3 indicates that 1-(4-Isothiocyanatophenylsulfonyl)piperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Isothiocyanatophenylsulfonyl)piperidine. Following Lipinski's Rule of Five, 1-(4-Isothiocyanatophenylsulfonyl)piperidine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(4-Isothiocyanatophenylsulfonyl)piperidine?
The CAS number of 1-(4-Isothiocyanatophenylsulfonyl)piperidine is 7356-55-0.
What is the molecular formula of 1-(4-Isothiocyanatophenylsulfonyl)piperidine?
The molecular formula of 1-(4-Isothiocyanatophenylsulfonyl)piperidine is C12H14N2O2S2.
What is the molecular weight of 1-(4-Isothiocyanatophenylsulfonyl)piperidine?
The molecular weight of 1-(4-Isothiocyanatophenylsulfonyl)piperidine is 282.04968 g/mol.
What are the applications of 1-(4-Isothiocyanatophenylsulfonyl)piperidine?
1-(4-Isothiocyanatophenylsulfonyl)piperidine is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy 1-(4-Isothiocyanatophenylsulfonyl)piperidine?
You can request a quote for 1-(4-Isothiocyanatophenylsulfonyl)piperidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Isothiocyanatophenylsulfonyl)piperidine?
Yes, CoreyChem provides custom synthesis services for 1-(4-Isothiocyanatophenylsulfonyl)piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.