BAS 06043548
TL;DR: BAS 06043548 (CAS 675826-89-8) is a chemical compound with molecular formula C22H18N4O3 and molecular weight 386.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-2-amino-5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile
Also Known As: BAS 06043548, (5E)-2-amino-5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile, (5E)-2-AMINO-5-[(6-ETHOXY-2H-1,3-BENZODIOXOL-5-YL)METHYLIDENE]-4,6-DIMETHYL-5H-CYCLOPENTA[B]PYRIDINE-3,7-DICARBONITRILE, (E)-2-amino-5-((6-ethoxybenzo[d][1,3]dioxol-5-yl)methylene)-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile, 2-amino-5-[(6-ethoxy(2H-benzo[d]1,3-dioxolen-5-yl))methylene]-4,6-dimethylcycl openta[2,1-b]pyridine-3,7-dicarbonitrile
| Molecular Formula | C22H18N4O3 |
|---|---|
| Molecular Weight | 386.14 g/mol |
| LogP | 3.82258 |
| Topological Polar Surface Area | 114.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.13788 |
| Heavy Atoms | 29 |
| Complexity | 1196.249 |
Chemical Identifiers
| CAS Number | 675826-89-8 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1/C=C/3\C(=C(C4=C3C(=C(C(=N4)N)C#N)C)C#N)C)OCO2 |
Product Overview
BAS 06043548 (CAS 675826-89-8), with molecular formula C22H18N4O3 and molecular weight 386.14 g/mol. IUPAC: (5E)-2-amino-5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile.
Chemical Property Profile of BAS 06043548
Property Insights of BAS 06043548
The XLogP value of 3.82258 indicates that BAS 06043548 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.18 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06043548. Following Lipinski's Rule of Five, BAS 06043548 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 06043548?
The CAS number of BAS 06043548 is 675826-89-8.
What is the molecular formula of BAS 06043548?
The molecular formula of BAS 06043548 is C22H18N4O3.
What is the molecular weight of BAS 06043548?
The molecular weight of BAS 06043548 is 386.14 g/mol.
Where can I buy BAS 06043548?
You can request a quote for BAS 06043548 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06043548?
Yes, KEHONG BIO provides custom synthesis services for BAS 06043548 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.