3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one
TL;DR: 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one (CAS 99507-54-7) is a chemical compound with molecular formula C20H23NOS and molecular weight 325.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-3-phenylsulfanyl-1-piperidin-1-ylpropan-1-one
Also Known As: 1-(beta-(Phenylthio)hydrocinnamoyl)piperidine, Piperidine, 1-(beta-(phenylthio)hydrocinnamoyl)-, Piperidine, 1-(1-oxo-3-phenyl-3-(phenylthio)propyl)-, 3-phenyl-3-phenylsulfanyl-1-piperidin-1-ylpropan-1-one, 3-PHENYL-3-(PHENYLSULFANYL)-1-(PIPERIDIN-1-YL)PROPAN-1-ONE
| Molecular Formula | C20H23NOS |
|---|---|
| Molecular Weight | 325.15 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 45.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.15002 |
| Heavy Atoms | 23 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 99507-54-7 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)CC(C2=CC=CC=C2)SC3=CC=CC=C3 |
| InChIKey | GXTABIWPRLPCQH-UHFFFAOYSA-N |
Product Overview
3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one (CAS 99507-54-7), with molecular formula C20H23NOS and molecular weight 325.15 g/mol. IUPAC: 3-phenyl-3-phenylsulfanyl-1-piperidin-1-ylpropan-1-one.
Chemical Property Profile of 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one
Property Insights of 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one
The XLogP value of 4.2 indicates that 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.6 Ų, 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one has 0 hydrogen bond donor(s) and 2 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 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one?
The CAS number of 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one is 99507-54-7.
What is the molecular formula of 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one?
The molecular formula of 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one is C20H23NOS.
What is the molecular weight of 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one?
The molecular weight of 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one is 325.15 g/mol.
Where can I buy 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one?
You can request a quote for 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-3-(phenylsulfanyl)-1-(piperidin-1-yl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.