VU0513402-1
TL;DR: VU0513402-1 (CAS 898508-32-2) is a chemical compound with molecular formula C23H23N3O4 and molecular weight 405.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzylpiperazin-1-yl)-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazol-3-yl]methanone
Also Known As: VU0513402-1, (4-benzylpiperazin-1-yl)(5-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)isoxazol-3-yl)methanone, F3216-0700, (4-benzylpiperazin-1-yl)-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazol-3-yl]methanone, 1-BENZYL-4-[5-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-1,2-OXAZOLE-3-CARBONYL]PIPERAZINE
| Molecular Formula | C23H23N3O4 |
|---|---|
| Molecular Weight | 405.17 g/mol |
| LogP | 3.0708 |
| Topological Polar Surface Area | 68.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.16885 |
| Heavy Atoms | 30 |
| Complexity | 1025.9373 |
Chemical Identifiers
| CAS Number | 898508-32-2 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=NOC(=C3)C4=CC5=C(C=C4)OCCO5 |
Product Overview
VU0513402-1 (CAS 898508-32-2), with molecular formula C23H23N3O4 and molecular weight 405.17 g/mol. IUPAC: (4-benzylpiperazin-1-yl)-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazol-3-yl]methanone.
Chemical Property Profile of VU0513402-1
Property Insights of VU0513402-1
The XLogP value of 3.0708 indicates that VU0513402-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.04 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0513402-1. Following Lipinski's Rule of Five, VU0513402-1 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 VU0513402-1?
The CAS number of VU0513402-1 is 898508-32-2.
What is the molecular formula of VU0513402-1?
The molecular formula of VU0513402-1 is C23H23N3O4.
What is the molecular weight of VU0513402-1?
The molecular weight of VU0513402-1 is 405.17 g/mol.
Where can I buy VU0513402-1?
You can request a quote for VU0513402-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0513402-1?
Yes, KEHONG BIO provides custom synthesis services for VU0513402-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.