![1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone structure](/static/products/865/865659-33-2.png)
1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone
TL;DR: 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone (CAS 865659-33-2) is a chemical compound with molecular formula C18H26ClNO4S and molecular weight 387.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(2-chlorophenyl)methylsulfonylmethyl]-4-hydroxypiperidin-1-yl]-2,2-dimethylpropan-1-one
Also Known As: 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone, 1-(4-{[(2-chlorophenyl)methanesulfonyl]methyl}-4-hydroxypiperidin-1-yl)-2,2-dimethylpropan-1-one, 1-[4-[(2-chlorophenyl)methylsulfonylmethyl]-4-hydroxypiperidin-1-yl]-2,2-dimethylpropan-1-one, 1-[4-[(2-chlorophenyl)methylsulfonylmethyl]-4-hydroxy-1-piperidyl]-2,2-dimethyl-propan-1-one, 1-{4-[(2-chlorophenyl)methanesulfonylmethyl]-4-hydroxypiperidin-1-yl}-2,2-dimethylpropan-1-one
| Molecular Formula | C18H26ClNO4S |
|---|---|
| Molecular Weight | 387.13 g/mol |
| LogP | 2.6544 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.1271 |
| Heavy Atoms | 25 |
| Complexity | 731.6881 |
Chemical Identifiers
| CAS Number | 865659-33-2 |
|---|---|
| SMILES | CC(C)(C)C(=O)N1CCC(CC1)(CS(=O)(=O)CC2=CC=CC=C2Cl)O |
Product Overview
1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone (CAS 865659-33-2), with molecular formula C18H26ClNO4S and molecular weight 387.13 g/mol. IUPAC: 1-[4-[(2-chlorophenyl)methylsulfonylmethyl]-4-hydroxypiperidin-1-yl]-2,2-dimethylpropan-1-one.
Chemical Property Profile of 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone
Property Insights of 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone
The XLogP value of 2.6544 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone. Following Lipinski's Rule of Five, 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone 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 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone?
The CAS number of 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone is 865659-33-2.
What is the molecular formula of 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone?
The molecular formula of 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone is C18H26ClNO4S.
What is the molecular weight of 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone?
The molecular weight of 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone is 387.13 g/mol.
Where can I buy 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone?
You can request a quote for 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-{[(2-chlorobenzyl)sulfonyl]methyl}-4-hydroxypiperidino)-2,2-dimethyl-1-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.