![(4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone structure](/static/products/866/866019-54-7.png)
(4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone
TL;DR: (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone (CAS 866019-54-7) is a chemical compound with molecular formula C21H21ClF3NO4S and molecular weight 475.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(4-chlorophenyl)methylsulfonylmethyl]-4-hydroxypiperidin-1-yl]-[3-(trifluoromethyl)phenyl]methanone
Also Known As: (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone, 4-{[(4-chlorophenyl)methanesulfonyl]methyl}-1-[3-(trifluoromethyl)benzoyl]piperidin-4-ol, [4-[(4-chlorophenyl)methylsulfonylmethyl]-4-hydroxypiperidin-1-yl]-[3-(trifluoromethyl)phenyl]methanone, (4-([(4-CHLOROBENZYL)SULFONYL]METHYL)-4-HYDROXYPIPERIDINO)[3-(TRIFLUOROMETHYL)PHENYL]METHANONE
| Molecular Formula | C21H21ClF3NO4S |
|---|---|
| Molecular Weight | 475.08 g/mol |
| LogP | 3.9409 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.0832 |
| Heavy Atoms | 31 |
| Complexity | 1047.0397 |
Chemical Identifiers
| CAS Number | 866019-54-7 |
|---|---|
| SMILES | C1CN(CCC1(CS(=O)(=O)CC2=CC=C(C=C2)Cl)O)C(=O)C3=CC(=CC=C3)C(F)(F)F |
Product Overview
(4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone (CAS 866019-54-7), with molecular formula C21H21ClF3NO4S and molecular weight 475.08 g/mol. IUPAC: [4-[(4-chlorophenyl)methylsulfonylmethyl]-4-hydroxypiperidin-1-yl]-[3-(trifluoromethyl)phenyl]methanone.
Chemical Property Profile of (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone
Property Insights of (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone
The XLogP value of 3.9409 indicates that (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone. Following Lipinski's Rule of Five, (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone 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 (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone?
The CAS number of (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone is 866019-54-7.
What is the molecular formula of (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone?
The molecular formula of (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone is C21H21ClF3NO4S.
What is the molecular weight of (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone?
The molecular weight of (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone is 475.08 g/mol.
Where can I buy (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone?
You can request a quote for (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-{[(4-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)[3-(trifluoromethyl)phenyl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.