BAS 02500727
TL;DR: BAS 02500727 (CAS 425389-95-3) is a chemical compound with molecular formula C22H28N2O6 and molecular weight 416.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dimethoxyphenyl)-[4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone
Also Known As: BAS 02500727, BIM-0003661.P001, (3,4-dimethoxyphenyl)-[4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone, 4-{[4-(3,4-dimethoxybenzoyl)-1-piperazinyl]methyl}-2,6-dimethoxyphenol, (3,4-dimethoxyphenyl)(4-(4-hydroxy-3,5-dimethoxybenzyl)piperazin-1-yl)methanone
| Molecular Formula | C22H28N2O6 |
|---|---|
| Molecular Weight | 416.19 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.19473 |
| Heavy Atoms | 30 |
| Complexity | 528.0 |
Chemical Identifiers
| CAS Number | 425389-95-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=C(C(=C3)OC)O)OC)OC |
| InChIKey | VLYZVELYDGWWFT-UHFFFAOYSA-N |
Product Overview
BAS 02500727 (CAS 425389-95-3), with molecular formula C22H28N2O6 and molecular weight 416.19 g/mol. IUPAC: (3,4-dimethoxyphenyl)-[4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone.
Chemical Property Profile of BAS 02500727
Property Insights of BAS 02500727
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02500727. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02500727. Following Lipinski's Rule of Five, BAS 02500727 has 1 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 02500727?
The CAS number of BAS 02500727 is 425389-95-3.
What is the molecular formula of BAS 02500727?
The molecular formula of BAS 02500727 is C22H28N2O6.
What is the molecular weight of BAS 02500727?
The molecular weight of BAS 02500727 is 416.19 g/mol.
Where can I buy BAS 02500727?
You can request a quote for BAS 02500727 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02500727?
Yes, KEHONG BIO provides custom synthesis services for BAS 02500727 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.