1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine
TL;DR: 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine (CAS 775299-35-9) is a chemical compound with molecular formula C18H18N2O5S and molecular weight 374.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(benzenesulfonyl)piperazin-1-yl]-(1,3-benzodioxol-5-yl)methanone
Also Known As: 1-(1,3-benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine, AP-124/43333327, [4-(benzenesulfonyl)piperazin-1-yl]-(1,3-benzodioxol-5-yl)methanone, 1,3-benzodioxol-5-yl[4-(phenylsulfonyl)piperazin-1-yl]methanone, 1,3-BENZODIOXOL-5-YL[4-(PHENYLSULFONYL)PIPERAZINO]METHANONE
| Molecular Formula | C18H18N2O5S |
|---|---|
| Molecular Weight | 374.09 g/mol |
| LogP | 1.562 |
| Topological Polar Surface Area | 76.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.09363 |
| Heavy Atoms | 26 |
| Complexity | 921.85254 |
Chemical Identifiers
| CAS Number | 775299-35-9 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC=C4 |
Product Overview
1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine (CAS 775299-35-9), with molecular formula C18H18N2O5S and molecular weight 374.09 g/mol. IUPAC: [4-(benzenesulfonyl)piperazin-1-yl]-(1,3-benzodioxol-5-yl)methanone.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine
Property Insights of 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine
The XLogP value of 1.562 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine. The TPSA of 76.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine 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 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine?
The CAS number of 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine is 775299-35-9.
What is the molecular formula of 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine?
The molecular formula of 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine is C18H18N2O5S.
What is the molecular weight of 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine?
The molecular weight of 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine is 374.09 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine?
You can request a quote for 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-ylcarbonyl)-4-(phenylsulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.