VU0617007-1
TL;DR: VU0617007-1 (CAS 902018-15-9) is a chemical compound with molecular formula C22H21ClN2O4 and molecular weight 412.12 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-chlorochromen-2-one
Also Known As: VU0617007-1, 4-((4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)methyl)-6-chloro-2H-chromen-2-one, F3385-2221, 4-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-6-chloro-2H-chromen-2-one, 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-6-chlorochromen-2-one
| Molecular Formula | C22H21ClN2O4 |
|---|---|
| Molecular Weight | 412.12 g/mol |
| LogP | 3.4929 |
| Topological Polar Surface Area | 55.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.119 |
| Heavy Atoms | 29 |
| Complexity | 1105.6528 |
Chemical Identifiers
| CAS Number | 902018-15-9 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC4=CC(=O)OC5=C4C=C(C=C5)Cl |
Product Overview
VU0617007-1 (CAS 902018-15-9), with molecular formula C22H21ClN2O4 and molecular weight 412.12 g/mol. IUPAC: 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-6-chlorochromen-2-one.
Chemical Property Profile of VU0617007-1
Property Insights of VU0617007-1
The XLogP value of 3.4929 indicates that VU0617007-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.15 Ų, VU0617007-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0617007-1 has 0 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 VU0617007-1?
The CAS number of VU0617007-1 is 902018-15-9.
What is the molecular formula of VU0617007-1?
The molecular formula of VU0617007-1 is C22H21ClN2O4.
What is the molecular weight of VU0617007-1?
The molecular weight of VU0617007-1 is 412.12 g/mol.
Where can I buy VU0617007-1?
You can request a quote for VU0617007-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0617007-1?
Yes, KEHONG BIO provides custom synthesis services for VU0617007-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.