BAS 06575028
TL;DR: BAS 06575028 (CAS 664971-79-3) is a chemical compound with molecular formula C20H18N2O2 and molecular weight 318.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-7,7-dimethyl-5-oxo-4-(2-phenylethynyl)-6,8-dihydro-4H-chromene-3-carbonitrile
Also Known As: BAS 06575028, 2-amino-7,7-dimethyl-5-oxo-4-(phenylethynyl)-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, AJ-292/42034936, A3472/0147222, 2-amino-7,7-dimethyl-5-oxo-4-(2-phenylethynyl)-6,8-dihydro-4H-chromene-3-carbonitrile
| Molecular Formula | C20H18N2O2 |
|---|---|
| Molecular Weight | 318.14 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 318.13684 |
| Heavy Atoms | 24 |
| Complexity | 742.0 |
Chemical Identifiers
| CAS Number | 664971-79-3 |
|---|---|
| SMILES | CC1(CC2=C(C(C(=C(O2)N)C#N)C#CC3=CC=CC=C3)C(=O)C1)C |
| InChIKey | PDGWLXMAHRVODU-UHFFFAOYSA-N |
Product Overview
BAS 06575028 (CAS 664971-79-3), with molecular formula C20H18N2O2 and molecular weight 318.14 g/mol. IUPAC: 2-amino-7,7-dimethyl-5-oxo-4-(2-phenylethynyl)-6,8-dihydro-4H-chromene-3-carbonitrile.
Chemical Property Profile of BAS 06575028
Property Insights of BAS 06575028
The XLogP value of 3.2 indicates that BAS 06575028 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06575028. Following Lipinski's Rule of Five, BAS 06575028 has 1 hydrogen bond donor(s) and 4 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 06575028?
The CAS number of BAS 06575028 is 664971-79-3.
What is the molecular formula of BAS 06575028?
The molecular formula of BAS 06575028 is C20H18N2O2.
What is the molecular weight of BAS 06575028?
The molecular weight of BAS 06575028 is 318.14 g/mol.
Where can I buy BAS 06575028?
You can request a quote for BAS 06575028 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06575028?
Yes, KEHONG BIO provides custom synthesis services for BAS 06575028 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.