BAS 06911508
TL;DR: BAS 06911508 (CAS 585562-32-9) is a chemical compound with molecular formula C21H22N4O3 and molecular weight 378.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
Also Known As: BAS 06911508, SDCCGSBI-0090419.P001, 1-(1,3-benzodioxol-5-ylmethyl)-4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperazine, 5-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole, 5-((4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)methyl)-3-phenyl-1,2,4-oxadiazole
| Molecular Formula | C21H22N4O3 |
|---|---|
| Molecular Weight | 378.17 g/mol |
| LogP | 2.7831 |
| Topological Polar Surface Area | 63.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.1692 |
| Heavy Atoms | 28 |
| Complexity | 935.83356 |
Chemical Identifiers
| CAS Number | 585562-32-9 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC4=NC(=NO4)C5=CC=CC=C5 |
Product Overview
BAS 06911508 (CAS 585562-32-9), with molecular formula C21H22N4O3 and molecular weight 378.17 g/mol. IUPAC: 5-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole.
Chemical Property Profile of BAS 06911508
Property Insights of BAS 06911508
The XLogP value of 2.7831 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06911508. The TPSA of 63.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06911508. Following Lipinski's Rule of Five, BAS 06911508 has 0 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 BAS 06911508?
The CAS number of BAS 06911508 is 585562-32-9.
What is the molecular formula of BAS 06911508?
The molecular formula of BAS 06911508 is C21H22N4O3.
What is the molecular weight of BAS 06911508?
The molecular weight of BAS 06911508 is 378.17 g/mol.
Where can I buy BAS 06911508?
You can request a quote for BAS 06911508 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06911508?
Yes, KEHONG BIO provides custom synthesis services for BAS 06911508 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.