BAS 07416952
TL;DR: BAS 07416952 (CAS 339187-81-4) is a chemical compound with molecular formula C20H12N2O5 and molecular weight 360.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(1,3-benzodioxol-5-yl)-5-oxo-4H-pyrano[3,2-c]chromene-3-carbonitrile
Also Known As: BAS 07416952, A0443/0020434, 2-amino-4-(1,3-benzodioxol-5-yl)-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile, 2-amino-4-(1,3-benzodioxol-5-yl)-5-oxo-4H-pyrano[3,2-c]chromene-3-carbonitrile, 2-AMINO-4-(2H-1,3-BENZODIOXOL-5-YL)-5-OXO-4H,5H-PYRANO[3,2-C]CHROMENE-3-CARBONITRILE
| Molecular Formula | C20H12N2O5 |
|---|---|
| Molecular Weight | 360.07 g/mol |
| LogP | 2.73988 |
| Topological Polar Surface Area | 107.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 360.07462 |
| Heavy Atoms | 27 |
| Complexity | 1235.3312 |
Chemical Identifiers
| CAS Number | 339187-81-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C3C(=C(OC4=C3C(=O)OC5=CC=CC=C54)N)C#N |
Product Overview
BAS 07416952 (CAS 339187-81-4), with molecular formula C20H12N2O5 and molecular weight 360.07 g/mol. IUPAC: 2-amino-4-(1,3-benzodioxol-5-yl)-5-oxo-4H-pyrano[3,2-c]chromene-3-carbonitrile.
Chemical Property Profile of BAS 07416952
Property Insights of BAS 07416952
The XLogP value of 2.73988 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07416952. The TPSA of 107.71 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07416952. Following Lipinski's Rule of Five, BAS 07416952 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 07416952?
The CAS number of BAS 07416952 is 339187-81-4.
What is the molecular formula of BAS 07416952?
The molecular formula of BAS 07416952 is C20H12N2O5.
What is the molecular weight of BAS 07416952?
The molecular weight of BAS 07416952 is 360.07 g/mol.
Where can I buy BAS 07416952?
You can request a quote for BAS 07416952 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07416952?
Yes, KEHONG BIO provides custom synthesis services for BAS 07416952 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.