BAS 02072948
TL;DR: BAS 02072948 (CAS 85459-83-2) is a chemical compound with molecular formula C20H14Cl2N2O3 and molecular weight 400.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-[5-(3,4-dichlorophenyl)furan-2-yl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile
Also Known As: BAS 02072948, 2-amino-4-[5-(3,4-dichlorophenyl)furan-2-yl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, 2-amino-4-(5-(3,4-dichlorophenyl)furan-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, 2-amino-4-[5-(3,4-dichlorophenyl)furan-2-yl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile
| Molecular Formula | C20H14Cl2N2O3 |
|---|---|
| Molecular Weight | 400.04 g/mol |
| LogP | 5.06818 |
| Topological Polar Surface Area | 89.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 400.03815 |
| Heavy Atoms | 27 |
| Complexity | 1059.4194 |
Chemical Identifiers
| CAS Number | 85459-83-2 |
|---|---|
| SMILES | C1CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(O3)C4=CC(=C(C=C4)Cl)Cl)C(=O)C1 |
Product Overview
BAS 02072948 (CAS 85459-83-2), with molecular formula C20H14Cl2N2O3 and molecular weight 400.04 g/mol. IUPAC: 2-amino-4-[5-(3,4-dichlorophenyl)furan-2-yl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile.
Chemical Property Profile of BAS 02072948
Property Insights of BAS 02072948
The XLogP value of 5.06818 indicates that BAS 02072948 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.25 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02072948. Following Lipinski's Rule of Five, BAS 02072948 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02072948?
The CAS number of BAS 02072948 is 85459-83-2.
What is the molecular formula of BAS 02072948?
The molecular formula of BAS 02072948 is C20H14Cl2N2O3.
What is the molecular weight of BAS 02072948?
The molecular weight of BAS 02072948 is 400.04 g/mol.
Where can I buy BAS 02072948?
You can request a quote for BAS 02072948 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02072948?
Yes, KEHONG BIO provides custom synthesis services for BAS 02072948 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.