BAS 00609489
TL;DR: BAS 00609489 (CAS 107752-87-4) is a chemical compound with molecular formula C18H18FNO4 and molecular weight 331.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-4-(4-fluorophenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate
Also Known As: BAS 00609489, J2.910.960E, ethyl 2-amino-4-(4-fluorophenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate, AB00079642-01, 2-AMINO-4-(4-F-PH)-5-OXO-5,6,7,8-4H-4H-CHROMENE-3-CARBOXYLIC ACID ETHYL ESTER
| Molecular Formula | C18H18FNO4 |
|---|---|
| Molecular Weight | 331.12 g/mol |
| LogP | 2.68 |
| Topological Polar Surface Area | 78.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.12198 |
| Heavy Atoms | 24 |
| Complexity | 748.7872 |
Chemical Identifiers
| CAS Number | 107752-87-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C(C1C3=CC=C(C=C3)F)C(=O)CCC2)N |
Product Overview
BAS 00609489 (CAS 107752-87-4), with molecular formula C18H18FNO4 and molecular weight 331.12 g/mol. IUPAC: ethyl 2-amino-4-(4-fluorophenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate.
Chemical Property Profile of BAS 00609489
Property Insights of BAS 00609489
The XLogP value of 2.68 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00609489. The TPSA of 78.62 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00609489. Following Lipinski's Rule of Five, BAS 00609489 has 1 hydrogen bond donor(s) and 5 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 00609489?
The CAS number of BAS 00609489 is 107752-87-4.
What is the molecular formula of BAS 00609489?
The molecular formula of BAS 00609489 is C18H18FNO4.
What is the molecular weight of BAS 00609489?
The molecular weight of BAS 00609489 is 331.12 g/mol.
Where can I buy BAS 00609489?
You can request a quote for BAS 00609489 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00609489?
Yes, KEHONG BIO provides custom synthesis services for BAS 00609489 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.