[4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone
TL;DR: [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone (CAS 915868-69-8) is a chemical compound with molecular formula C21H25NO3S and molecular weight 371.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone
Also Known As: [4-(benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone|{4-[(benzylsulfonyl)methyl]phenyl}(4-methylpiperidin-1-yl)methanone|MLS001160538|SMR000670225
| Molecular Formula | C21H25NO3S |
|---|---|
| Molecular Weight | 371.16 g/mol |
| LogP | 3.6737 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.15552 |
| Heavy Atoms | 26 |
| Complexity | 836.5847 |
Chemical Identifiers
| CAS Number | 915868-69-8 |
|---|---|
| SMILES | CC1CCN(CC1)C(=O)C2=CC=C(C=C2)CS(=O)(=O)CC3=CC=CC=C3 |
Product Overview
[4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone (CAS 915868-69-8), with molecular formula C21H25NO3S and molecular weight 371.16 g/mol. IUPAC: [4-(benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone.
Chemical Property Profile of [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone
Property Insights of [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone
The XLogP value of 3.6737 indicates that [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.45 Ų, [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone 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 [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone?
The CAS number of [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone is 915868-69-8.
What is the molecular formula of [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone?
The molecular formula of [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone is C21H25NO3S.
What is the molecular weight of [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone?
The molecular weight of [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone is 371.16 g/mol.
Where can I buy [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone?
You can request a quote for [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [4-(Benzylsulfonylmethyl)phenyl]-(4-methylpiperidin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.