methanone structure](/static/products/349/349620-01-5.png)
[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone
TL;DR: [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone (CAS 349620-01-5) is a chemical compound with molecular formula C19H19IN2O3 and molecular weight 450.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-iodophenyl)methanone
Also Known As: (4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)(2-iodophenyl)methanone, [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone, [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-iodophenyl)methanone, [4-(benzo[1,3]dioxol-5-ylmethyl)piperazin-1-yl]-(2-iodophenyl)methanone
| Molecular Formula | C19H19IN2O3 |
|---|---|
| Molecular Weight | 450.04 g/mol |
| LogP | 2.9779 |
| Topological Polar Surface Area | 42.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 450.04404 |
| Heavy Atoms | 25 |
| Complexity | 787.9887 |
Chemical Identifiers
| CAS Number | 349620-01-5 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4I |
Product Overview
[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone (CAS 349620-01-5), with molecular formula C19H19IN2O3 and molecular weight 450.04 g/mol. IUPAC: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-iodophenyl)methanone.
Chemical Property Profile of [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone
Property Insights of [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone
The XLogP value of 2.9779 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone. With a topological polar surface area (TPSA) of 42.01 Ų, [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone has 0 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 [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone?
The CAS number of [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone is 349620-01-5.
What is the molecular formula of [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone?
The molecular formula of [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone is C19H19IN2O3.
What is the molecular weight of [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone?
The molecular weight of [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone is 450.04 g/mol.
Where can I buy [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone?
You can request a quote for [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl](2-iodophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.