VU0617000-1
TL;DR: VU0617000-1 (CAS 896806-48-7) is a chemical compound with molecular formula C24H26N2O5 and molecular weight 422.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-6-ethyl-7-hydroxychromen-2-one
Also Known As: VU0617000-1, 4-((4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)methyl)-6-ethyl-7-hydroxy-2H-chromen-2-one, 4-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-6-ethyl-7-hydroxy-2H-chromen-2-one, F3385-2145, 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-6-ethyl-7-hydroxychromen-2-one
| Molecular Formula | C24H26N2O5 |
|---|---|
| Molecular Weight | 422.18 g/mol |
| LogP | 3.1075 |
| Topological Polar Surface Area | 75.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.18417 |
| Heavy Atoms | 31 |
| Complexity | 1164.5787 |
Chemical Identifiers
| CAS Number | 896806-48-7 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1O)OC(=O)C=C2CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5 |
Product Overview
VU0617000-1 (CAS 896806-48-7), with molecular formula C24H26N2O5 and molecular weight 422.18 g/mol. IUPAC: 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-6-ethyl-7-hydroxychromen-2-one.
Chemical Property Profile of VU0617000-1
Property Insights of VU0617000-1
The XLogP value of 3.1075 indicates that VU0617000-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.38 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0617000-1. Following Lipinski's Rule of Five, VU0617000-1 has 1 hydrogen bond donor(s) and 7 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 VU0617000-1?
The CAS number of VU0617000-1 is 896806-48-7.
What is the molecular formula of VU0617000-1?
The molecular formula of VU0617000-1 is C24H26N2O5.
What is the molecular weight of VU0617000-1?
The molecular weight of VU0617000-1 is 422.18 g/mol.
Where can I buy VU0617000-1?
You can request a quote for VU0617000-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0617000-1?
Yes, KEHONG BIO provides custom synthesis services for VU0617000-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.