BAS 07415839
TL;DR: BAS 07415839 (CAS 305864-84-0) is a chemical compound with molecular formula C19H19FN2O5 and molecular weight 374.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(3-fluorophenyl)-4H-pyran-3-carboxylate
Also Known As: BAS 07415839, ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(3-fluorophenyl)-4H-pyran-3-carboxylate, AB00095469-01, AN-512/12594178, ethyl 2-[6-amino-5-cyano-3-(ethoxycarbonyl)-4-(3-fluorophenyl)-4H-pyran-2-yl]a cetate
| Molecular Formula | C19H19FN2O5 |
|---|---|
| Molecular Weight | 374.13 g/mol |
| LogP | 2.40378 |
| Topological Polar Surface Area | 111.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 374.1278 |
| Heavy Atoms | 27 |
| Complexity | 853.9011 |
Chemical Identifiers
| CAS Number | 305864-84-0 |
|---|---|
| SMILES | CCOC(=O)CC1=C(C(C(=C(O1)N)C#N)C2=CC(=CC=C2)F)C(=O)OCC |
Product Overview
BAS 07415839 (CAS 305864-84-0), with molecular formula C19H19FN2O5 and molecular weight 374.13 g/mol. IUPAC: ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(3-fluorophenyl)-4H-pyran-3-carboxylate.
Chemical Property Profile of BAS 07415839
Property Insights of BAS 07415839
The XLogP value of 2.40378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07415839. The TPSA of 111.64 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07415839. Following Lipinski's Rule of Five, BAS 07415839 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 07415839?
The CAS number of BAS 07415839 is 305864-84-0.
What is the molecular formula of BAS 07415839?
The molecular formula of BAS 07415839 is C19H19FN2O5.
What is the molecular weight of BAS 07415839?
The molecular weight of BAS 07415839 is 374.13 g/mol.
Where can I buy BAS 07415839?
You can request a quote for BAS 07415839 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07415839?
Yes, KEHONG BIO provides custom synthesis services for BAS 07415839 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.