4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide
TL;DR: 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide (CAS 516459-77-1) is a chemical compound with molecular formula C12H17N3O3S2 and molecular weight 315.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide
Also Known As: ChemDiv3_005838, 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide, IDI1_023748, BRD-K24599443-001-01-1, N-[4-(aminosulfonyl)phenyl]-4-hydroxy-1-piperidinecarbothioamide
| Molecular Formula | C12H17N3O3S2 |
|---|---|
| Molecular Weight | 315.07 g/mol |
| LogP | 0.4875 |
| Topological Polar Surface Area | 95.66 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 315.07114 |
| Heavy Atoms | 20 |
| Complexity | 578.47003 |
Chemical Identifiers
| CAS Number | 516459-77-1 |
|---|---|
| SMILES | C1CN(CCC1O)C(=S)NC2=CC=C(C=C2)S(=O)(=O)N |
Product Overview
4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide (CAS 516459-77-1), with molecular formula C12H17N3O3S2 and molecular weight 315.07 g/mol. IUPAC: 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide.
Chemical Property Profile of 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide
Property Insights of 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide
The XLogP value of 0.4875 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide. The TPSA of 95.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide. Following Lipinski's Rule of Five, 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide has 3 hydrogen bond donor(s) and 4 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-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide?
The CAS number of 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide is 516459-77-1.
What is the molecular formula of 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide?
The molecular formula of 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide is C12H17N3O3S2.
What is the molecular weight of 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide?
The molecular weight of 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide is 315.07 g/mol.
Where can I buy 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide?
You can request a quote for 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-hydroxy-N-(4-sulfamoylphenyl)piperidine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.