BAS 07416698
TL;DR: BAS 07416698 (CAS 329934-89-6) is a chemical compound with molecular formula C18H16FNO5 and molecular weight 345.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-4-(2-fluorophenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carboxylate
Also Known As: BAS 07416698, ethyl 2-amino-4-(2-fluorophenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carboxylate, ethyl 2-amino-4-(2-fluorophenyl)-7-methyl-5-oxo-4,5-dihydropyrano[4,3-b]pyran-3-carboxylate, ethyl 2-amino-4-(2-fluorophenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carboxylate, ethyl 2-amino-4-(2-fluorophenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbox ylate
| Molecular Formula | C18H16FNO5 |
|---|---|
| Molecular Weight | 345.10 g/mol |
| LogP | 2.34502 |
| Topological Polar Surface Area | 91.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.10126 |
| Heavy Atoms | 25 |
| Complexity | 931.30396 |
Chemical Identifiers
| CAS Number | 329934-89-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C(C1C3=CC=CC=C3F)C(=O)OC(=C2)C)N |
Product Overview
BAS 07416698 (CAS 329934-89-6), with molecular formula C18H16FNO5 and molecular weight 345.10 g/mol. IUPAC: ethyl 2-amino-4-(2-fluorophenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carboxylate.
Chemical Property Profile of BAS 07416698
Property Insights of BAS 07416698
The XLogP value of 2.34502 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07416698. The TPSA of 91.76 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07416698. Following Lipinski's Rule of Five, BAS 07416698 has 1 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 07416698?
The CAS number of BAS 07416698 is 329934-89-6.
What is the molecular formula of BAS 07416698?
The molecular formula of BAS 07416698 is C18H16FNO5.
What is the molecular weight of BAS 07416698?
The molecular weight of BAS 07416698 is 345.10 g/mol.
Where can I buy BAS 07416698?
You can request a quote for BAS 07416698 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07416698?
Yes, KEHONG BIO provides custom synthesis services for BAS 07416698 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.