BAS 07414692
TL;DR: BAS 07414692 (CAS 698977-44-5) is a chemical compound with molecular formula C16H10ClFN2O4 and molecular weight 348.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(2-chloro-6-fluorophenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile
Also Known As: BAS 07414692, 2-amino-4-(2-chloro-6-fluorophenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile, AM-807/41931616, 2-amino-4-(2-chloro-6-fluorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile, A3663/0155257
| Molecular Formula | C16H10ClFN2O4 |
|---|---|
| Molecular Weight | 348.03 g/mol |
| LogP | 2.14278 |
| Topological Polar Surface Area | 109.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 348.0313 |
| Heavy Atoms | 24 |
| Complexity | 941.2754 |
Chemical Identifiers
| CAS Number | 698977-44-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)C2C(=C(OC3=C2OC(=CC3=O)CO)N)C#N)F |
Product Overview
BAS 07414692 (CAS 698977-44-5), with molecular formula C16H10ClFN2O4 and molecular weight 348.03 g/mol. IUPAC: 2-amino-4-(2-chloro-6-fluorophenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile.
Chemical Property Profile of BAS 07414692
Property Insights of BAS 07414692
The XLogP value of 2.14278 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07414692. The TPSA of 109.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07414692. Following Lipinski's Rule of Five, BAS 07414692 has 2 hydrogen bond donor(s) and 6 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 07414692?
The CAS number of BAS 07414692 is 698977-44-5.
What is the molecular formula of BAS 07414692?
The molecular formula of BAS 07414692 is C16H10ClFN2O4.
What is the molecular weight of BAS 07414692?
The molecular weight of BAS 07414692 is 348.03 g/mol.
Where can I buy BAS 07414692?
You can request a quote for BAS 07414692 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07414692?
Yes, KEHONG BIO provides custom synthesis services for BAS 07414692 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.