VU0616958-1
TL;DR: VU0616958-1 (CAS 862485-11-8) is a chemical compound with molecular formula C25H28N2O4 and molecular weight 420.20 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-propan-2-ylchromen-2-one
Also Known As: VU0616958-1, 4-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-6-(propan-2-yl)-2H-chromen-2-one, F3385-1923, 4-((4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)methyl)-6-isopropyl-2H-chromen-2-one, 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-6-propan-2-ylchromen-2-one
| Molecular Formula | C25H28N2O4 |
|---|---|
| Molecular Weight | 420.20 g/mol |
| LogP | 3.9629 |
| Topological Polar Surface Area | 55.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.2049 |
| Heavy Atoms | 31 |
| Complexity | 1145.9574 |
Chemical Identifiers
| CAS Number | 862485-11-8 |
|---|---|
| SMILES | CC(C)C1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5 |
Product Overview
VU0616958-1 (CAS 862485-11-8), with molecular formula C25H28N2O4 and molecular weight 420.20 g/mol. IUPAC: 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-6-propan-2-ylchromen-2-one.
Chemical Property Profile of VU0616958-1
Property Insights of VU0616958-1
The XLogP value of 3.9629 indicates that VU0616958-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.15 Ų, VU0616958-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0616958-1 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 VU0616958-1?
The CAS number of VU0616958-1 is 862485-11-8.
What is the molecular formula of VU0616958-1?
The molecular formula of VU0616958-1 is C25H28N2O4.
What is the molecular weight of VU0616958-1?
The molecular weight of VU0616958-1 is 420.20 g/mol.
Where can I buy VU0616958-1?
You can request a quote for VU0616958-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0616958-1?
Yes, KEHONG BIO provides custom synthesis services for VU0616958-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.