4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone
TL;DR: 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone (CAS 873675-08-2) is a chemical compound with molecular formula C20H26N2O5S and molecular weight 406.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(3-tert-butyl-4-methoxyphenyl)sulfonylpiperazin-1-yl]-(furan-2-yl)methanone
Also Known As: ASN 12914861, VU0512819-1, 4-{[3-(tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone, [4-(3-tert-butyl-4-methoxyphenyl)sulfonylpiperazin-1-yl]-(furan-2-yl)methanone, 1-(3-tert-butyl-4-methoxybenzenesulfonyl)-4-(furan-2-carbonyl)piperazine
| Molecular Formula | C20H26N2O5S |
|---|---|
| Molecular Weight | 406.16 g/mol |
| LogP | 2.7324 |
| Topological Polar Surface Area | 80.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 406.15625 |
| Heavy Atoms | 28 |
| Complexity | 937.4708 |
Chemical Identifiers
| CAS Number | 873675-08-2 |
|---|---|
| SMILES | CC(C)(C)C1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3)OC |
Product Overview
4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone (CAS 873675-08-2), with molecular formula C20H26N2O5S and molecular weight 406.16 g/mol. IUPAC: [4-(3-tert-butyl-4-methoxyphenyl)sulfonylpiperazin-1-yl]-(furan-2-yl)methanone.
Chemical Property Profile of 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone
Property Insights of 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone
The XLogP value of 2.7324 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone. The TPSA of 80.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone. Following Lipinski's Rule of Five, 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone has 0 hydrogen bond donor(s) and 5 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-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone?
The CAS number of 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone is 873675-08-2.
What is the molecular formula of 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone?
The molecular formula of 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone is C20H26N2O5S.
What is the molecular weight of 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone?
The molecular weight of 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone is 406.16 g/mol.
Where can I buy 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone?
You can request a quote for 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 4-{[3-(Tert-butyl)-4-methoxyphenyl]sulfonyl}piperazinyl 2-furyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.