1-(Benzylsulfonyl)piperidin-4-one
TL;DR: 1-(Benzylsulfonyl)piperidin-4-one (CAS 267666-08-0) is a chemical compound with molecular formula C12H15NO3S and molecular weight 253.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzylsulfonylpiperidin-4-one
Also Known As: 1-(benzylsulfonyl)piperidin-4-one, 1-benzylsulfonylpiperidin-4-one, ghl.PD_Mitscher_leg0.837, 1-phenylmethanesulfonylpiperidin-4-one, 1-[(phenylmethyl)sulfonyl]-4-Piperidinone
| Molecular Formula | C12H15NO3S |
|---|---|
| Molecular Weight | 253.08 g/mol |
| LogP | 1.1813 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.07727 |
| Heavy Atoms | 17 |
| Complexity | 485.74185 |
Chemical Identifiers
| CAS Number | 267666-08-0 |
|---|---|
| SMILES | C1CN(CCC1=O)S(=O)(=O)CC2=CC=CC=C2 |
Product Overview
1-(Benzylsulfonyl)piperidin-4-one (CAS 267666-08-0), with molecular formula C12H15NO3S and molecular weight 253.08 g/mol. IUPAC: 1-benzylsulfonylpiperidin-4-one.
Chemical Property Profile of 1-(Benzylsulfonyl)piperidin-4-one
Property Insights of 1-(Benzylsulfonyl)piperidin-4-one
The XLogP value of 1.1813 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Benzylsulfonyl)piperidin-4-one. With a topological polar surface area (TPSA) of 54.45 Ų, 1-(Benzylsulfonyl)piperidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Benzylsulfonyl)piperidin-4-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-(Benzylsulfonyl)piperidin-4-one?
The CAS number of 1-(Benzylsulfonyl)piperidin-4-one is 267666-08-0.
What is the molecular formula of 1-(Benzylsulfonyl)piperidin-4-one?
The molecular formula of 1-(Benzylsulfonyl)piperidin-4-one is C12H15NO3S.
What is the molecular weight of 1-(Benzylsulfonyl)piperidin-4-one?
The molecular weight of 1-(Benzylsulfonyl)piperidin-4-one is 253.08 g/mol.
Where can I buy 1-(Benzylsulfonyl)piperidin-4-one?
You can request a quote for 1-(Benzylsulfonyl)piperidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzylsulfonyl)piperidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzylsulfonyl)piperidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.