BAS 00674448
TL;DR: BAS 00674448 (CAS 296261-91-1) is a chemical compound with molecular formula C20H19F4NO4 and molecular weight 413.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-[ethyl-(3-fluorobenzoyl)amino]phenyl]-3,3,3-trifluoro-2-hydroxypropanoate
Also Known As: BAS 00674448, ethyl 2-(4-{ethyl[(3-fluorophenyl)carbonyl]amino}phenyl)-3,3,3-trifluoro-2-hydroxypropanoate, ethyl 2-(4-(N-ethyl-3-fluorobenzamido)phenyl)-3,3,3-trifluoro-2-hydroxypropanoate, ethyl 2-[4-(N-ethyl-3-fluorobenzamido)phenyl]-3,3,3-trifluoro-2-hydroxypropanoate, ETHYL 2-[4-(N-ETHYL3-FLUOROBENZAMIDO)PHENYL]-3,3,3-TRIFLUORO-2-HYDROXYPROPANOATE
| Molecular Formula | C20H19F4NO4 |
|---|---|
| Molecular Weight | 413.13 g/mol |
| LogP | 3.8054 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.12503 |
| Heavy Atoms | 29 |
| Complexity | 882.7951 |
Chemical Identifiers
| CAS Number | 296261-91-1 |
|---|---|
| SMILES | CCN(C1=CC=C(C=C1)C(C(=O)OCC)(C(F)(F)F)O)C(=O)C2=CC(=CC=C2)F |
Product Overview
BAS 00674448 (CAS 296261-91-1), with molecular formula C20H19F4NO4 and molecular weight 413.13 g/mol. IUPAC: ethyl 2-[4-[ethyl-(3-fluorobenzoyl)amino]phenyl]-3,3,3-trifluoro-2-hydroxypropanoate.
Chemical Property Profile of BAS 00674448
Property Insights of BAS 00674448
The XLogP value of 3.8054 indicates that BAS 00674448 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00674448. Following Lipinski's Rule of Five, BAS 00674448 has 1 hydrogen bond donor(s) and 4 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 00674448?
The CAS number of BAS 00674448 is 296261-91-1.
What is the molecular formula of BAS 00674448?
The molecular formula of BAS 00674448 is C20H19F4NO4.
What is the molecular weight of BAS 00674448?
The molecular weight of BAS 00674448 is 413.13 g/mol.
Where can I buy BAS 00674448?
You can request a quote for BAS 00674448 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00674448?
Yes, KEHONG BIO provides custom synthesis services for BAS 00674448 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.