BAS 07415166
TL;DR: BAS 07415166 (CAS 876709-87-4) is a chemical compound with molecular formula C18H16N2O6 and molecular weight 356.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(3,5-dimethoxyphenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile
Also Known As: BAS 07415166, J3.155.173K, 2-amino-4-(3,5-dimethoxyphenyl)-6-(hydroxymethyl)-8-oxo-4H,8H-pyrano[3,2-b]pyran-3-carbonitrile, 2-amino-4-(3,5-dimethoxyphenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile, 2-amino-4-(3,5-dimethoxyphenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile
| Molecular Formula | C18H16N2O6 |
|---|---|
| Molecular Weight | 356.10 g/mol |
| LogP | 1.36748 |
| Topological Polar Surface Area | 127.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.10083 |
| Heavy Atoms | 26 |
| Complexity | 963.9014 |
Chemical Identifiers
| CAS Number | 876709-87-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)C2C(=C(OC3=C2OC(=CC3=O)CO)N)C#N)OC |
Product Overview
BAS 07415166 (CAS 876709-87-4), with molecular formula C18H16N2O6 and molecular weight 356.10 g/mol. IUPAC: 2-amino-4-(3,5-dimethoxyphenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile.
Chemical Property Profile of BAS 07415166
Property Insights of BAS 07415166
The XLogP value of 1.36748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07415166. The TPSA of 127.94 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07415166. Following Lipinski's Rule of Five, BAS 07415166 has 2 hydrogen bond donor(s) and 8 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 07415166?
The CAS number of BAS 07415166 is 876709-87-4.
What is the molecular formula of BAS 07415166?
The molecular formula of BAS 07415166 is C18H16N2O6.
What is the molecular weight of BAS 07415166?
The molecular weight of BAS 07415166 is 356.10 g/mol.
Where can I buy BAS 07415166?
You can request a quote for BAS 07415166 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07415166?
Yes, KEHONG BIO provides custom synthesis services for BAS 07415166 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.