Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)-
TL;DR: Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)- (CAS 3398-28-5) is a chemical compound with molecular formula C19H21N3O3 and molecular weight 339.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-aminophenyl)-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methanone
Also Known As: D-trans-Hydroxyproli, 4-(4-Piperonylpiperazin-1-ylcarbonyl)aniline, 1-(4-Aminobenzoyl)-4-piperonylpiperazine, Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)-, 5-23-02-00530 (Beilstein Handbook Reference)
| Molecular Formula | C19H21N3O3 |
|---|---|
| Molecular Weight | 339.16 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 68.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.1583 |
| Heavy Atoms | 25 |
| Complexity | 459.0 |
Chemical Identifiers
| CAS Number | 3398-28-5 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)N |
| InChIKey | WUZKUFVUPDLNHA-UHFFFAOYSA-N |
Product Overview
Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)- (CAS 3398-28-5), with molecular formula C19H21N3O3 and molecular weight 339.16 g/mol. IUPAC: (4-aminophenyl)-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methanone.
Chemical Property Profile of Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)-
Property Insights of Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)-. The TPSA of 68.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)-. Following Lipinski's Rule of Five, Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)- has 1 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 Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)-?
The CAS number of Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)- is 3398-28-5.
What is the molecular formula of Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)-?
The molecular formula of Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)- is C19H21N3O3.
What is the molecular weight of Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)-?
The molecular weight of Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)- is 339.16 g/mol.
Where can I buy Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)-?
You can request a quote for Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)-?
Yes, KEHONG BIO provides custom synthesis services for Aniline, 4-(4-piperonylpiperazin-1-ylcarbonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.