1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide
TL;DR: 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide (CAS 67041-08-1) is a chemical compound with molecular formula C20H22N4O3 and molecular weight 366.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-phenylpiperazin-1-yl)acetamide
Also Known As: 4-Phenyl-1-piperazineacetic acid (1,3-benzodioxol-5-ylmethylene)hydrazide, 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide, RefChem:1056456, BRN 0856789
| Molecular Formula | C20H22N4O3 |
|---|---|
| Molecular Weight | 366.17 g/mol |
| LogP | 1.6876 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.1692 |
| Heavy Atoms | 27 |
| Complexity | 817.23145 |
Chemical Identifiers
| CAS Number | 67041-08-1 |
|---|---|
| SMILES | C1CN(CCN1CC(=O)N/N=C/C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4 |
Product Overview
1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide (CAS 67041-08-1), with molecular formula C20H22N4O3 and molecular weight 366.17 g/mol. IUPAC: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-phenylpiperazin-1-yl)acetamide.
Chemical Property Profile of 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide
Property Insights of 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide
The XLogP value of 1.6876 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide. Following Lipinski's Rule of Five, 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide has 1 hydrogen bond donor(s) and 6 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-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide?
The CAS number of 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide is 67041-08-1.
What is the molecular formula of 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide?
The molecular formula of 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide is C20H22N4O3.
What is the molecular weight of 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide?
The molecular weight of 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide is 366.17 g/mol.
Where can I buy 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide?
You can request a quote for 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazineacetic acid, 4-phenyl-, (1,3-benzodioxol-5-ylmethylene)hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.