AB00686864-01
TL;DR: AB00686864-01 (CAS 869078-55-7) is a chemical compound with molecular formula C22H24N2O4 and molecular weight 380.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-benzylidene-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1-benzofuran-3-one
Also Known As: AB00686864-01, (Z)-2-benzylidene-6-hydroxy-7-((4-(2-hydroxyethyl)piperazin-1-yl)methyl)benzofuran-3(2H)-one, F1860-0443, (2Z)-6-hydroxy-7-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2-(phenylmethylidene)-2,3-dihydro-1-benzofuran-3-one, (2Z)-2-benzylidene-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1-benzofuran-3-one
| Molecular Formula | C22H24N2O4 |
|---|---|
| Molecular Weight | 380.17 g/mol |
| LogP | 2.1183 |
| Topological Polar Surface Area | 73.24 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.1736 |
| Heavy Atoms | 28 |
| Complexity | 886.9098 |
Chemical Identifiers
| CAS Number | 869078-55-7 |
|---|---|
| SMILES | C1CN(CCN1CCO)CC2=C(C=CC3=C2O/C(=C\C4=CC=CC=C4)/C3=O)O |
Product Overview
AB00686864-01 (CAS 869078-55-7), with molecular formula C22H24N2O4 and molecular weight 380.17 g/mol. IUPAC: (2Z)-2-benzylidene-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1-benzofuran-3-one.
Chemical Property Profile of AB00686864-01
Property Insights of AB00686864-01
The XLogP value of 2.1183 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00686864-01. The TPSA of 73.24 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00686864-01. Following Lipinski's Rule of Five, AB00686864-01 has 2 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 AB00686864-01?
The CAS number of AB00686864-01 is 869078-55-7.
What is the molecular formula of AB00686864-01?
The molecular formula of AB00686864-01 is C22H24N2O4.
What is the molecular weight of AB00686864-01?
The molecular weight of AB00686864-01 is 380.17 g/mol.
Where can I buy AB00686864-01?
You can request a quote for AB00686864-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00686864-01?
Yes, KEHONG BIO provides custom synthesis services for AB00686864-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.