BAS 06699557
TL;DR: BAS 06699557 (CAS 667897-89-4) is a chemical compound with molecular formula C21H18N4O and molecular weight 342.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-2-amino-5-[(4-ethoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile
Also Known As: BAS 06699557, (5E)-2-amino-5-[(4-ethoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile, (E)-2-amino-5-(4-ethoxybenzylidene)-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile, 2-amino-5-[(4-ethoxyphenyl)methylene]-4,6-dimethylcyclopenta[2,1-b]pyridine-3, 7-dicarbonitrile
| Molecular Formula | C21H18N4O |
|---|---|
| Molecular Weight | 342.15 g/mol |
| LogP | 4.09388 |
| Topological Polar Surface Area | 95.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.14807 |
| Heavy Atoms | 26 |
| Complexity | 1031.6515 |
Chemical Identifiers
| CAS Number | 667897-89-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)/C=C/2\C(=C(C3=C2C(=C(C(=N3)N)C#N)C)C#N)C |
Product Overview
BAS 06699557 (CAS 667897-89-4), with molecular formula C21H18N4O and molecular weight 342.15 g/mol. IUPAC: (5E)-2-amino-5-[(4-ethoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile.
Chemical Property Profile of BAS 06699557
Property Insights of BAS 06699557
The XLogP value of 4.09388 indicates that BAS 06699557 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.72 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06699557. Following Lipinski's Rule of Five, BAS 06699557 has 1 hydrogen bond donor(s) and 5 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 06699557?
The CAS number of BAS 06699557 is 667897-89-4.
What is the molecular formula of BAS 06699557?
The molecular formula of BAS 06699557 is C21H18N4O.
What is the molecular weight of BAS 06699557?
The molecular weight of BAS 06699557 is 342.15 g/mol.
Where can I buy BAS 06699557?
You can request a quote for BAS 06699557 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06699557?
Yes, KEHONG BIO provides custom synthesis services for BAS 06699557 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.