1-Phenyl-3-(propane-1-sulfonyl)propan-1-one
TL;DR: 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one (CAS 50366-58-0) is a chemical compound with molecular formula C12H16O3S and molecular weight 240.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-propylsulfonylpropan-1-one
Also Known As: 1-phenyl-3-propylsulfonylpropan-1-one, 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one
| Molecular Formula | C12H16O3S |
|---|---|
| Molecular Weight | 240.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 59.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 240.08202 |
| Heavy Atoms | 16 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 50366-58-0 |
|---|---|
| SMILES | CCCS(=O)(=O)CCC(=O)C1=CC=CC=C1 |
| InChIKey | OMIZSKBMWVZVNS-UHFFFAOYSA-N |
Product Overview
1-Phenyl-3-(propane-1-sulfonyl)propan-1-one (CAS 50366-58-0), with molecular formula C12H16O3S and molecular weight 240.08 g/mol. IUPAC: 1-phenyl-3-propylsulfonylpropan-1-one.
Chemical Property Profile of 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one
Property Insights of 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one. With a topological polar surface area (TPSA) of 59.6 Ų, 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one has 0 hydrogen bond donor(s) and 3 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-Phenyl-3-(propane-1-sulfonyl)propan-1-one?
The CAS number of 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one is 50366-58-0.
What is the molecular formula of 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one?
The molecular formula of 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one is C12H16O3S.
What is the molecular weight of 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one?
The molecular weight of 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one is 240.08 g/mol.
Where can I buy 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one?
You can request a quote for 1-Phenyl-3-(propane-1-sulfonyl)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 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3-(propane-1-sulfonyl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.