1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide
TL;DR: 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide (CAS 895799-58-3) is a chemical compound with molecular formula C15H15ClN2O2S and molecular weight 322.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-chloro-4-oxothiochromen-3-yl)piperidine-4-carboxamide
Also Known As: 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide, 1-(6-chloro-4-oxothiochromen-3-yl)piperidine-4-carboxamide, F2032-0171
| Molecular Formula | C15H15ClN2O2S |
|---|---|
| Molecular Weight | 322.05 g/mol |
| LogP | 2.6166 |
| Topological Polar Surface Area | 63.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.0543 |
| Heavy Atoms | 21 |
| Complexity | 750.9123 |
Chemical Identifiers
| CAS Number | 895799-58-3 |
|---|---|
| SMILES | C1CN(CCC1C(=O)N)C2=CSC3=C(C2=O)C=C(C=C3)Cl |
Product Overview
1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide (CAS 895799-58-3), with molecular formula C15H15ClN2O2S and molecular weight 322.05 g/mol. IUPAC: 1-(6-chloro-4-oxothiochromen-3-yl)piperidine-4-carboxamide.
Chemical Property Profile of 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide
Property Insights of 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide
The XLogP value of 2.6166 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide. The TPSA of 63.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide. Following Lipinski's Rule of Five, 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide has 1 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 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide?
The CAS number of 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide is 895799-58-3.
What is the molecular formula of 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide?
The molecular formula of 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide is C15H15ClN2O2S.
What is the molecular weight of 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide?
The molecular weight of 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide is 322.05 g/mol.
Where can I buy 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide?
You can request a quote for 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-(6-chloro-4-oxo-4H-thiochromen-3-yl)piperidine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.