BAS 00674291
TL;DR: BAS 00674291 (CAS 294196-50-2) is a chemical compound with molecular formula C15H18F3NO5 and molecular weight 349.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[ethoxycarbonyl(ethyl)amino]phenyl]-3,3,3-trifluoro-2-hydroxypropanoate
Also Known As: BAS 00674291, methyl 2-{4-[(ethoxycarbonyl)(ethyl)amino]phenyl}-3,3,3-trifluoro-2-hydroxypropanoate, methyl 2-(4-((ethoxycarbonyl)(ethyl)amino)phenyl)-3,3,3-trifluoro-2-hydroxypropanoate, methyl 2-[4-(ethoxy-N-ethylcarbonylamino)phenyl]-3,3,3-trifluoro-2-hydroxyprop anoate, methyl 2-[4-[ethoxycarbonyl(ethyl)amino]phenyl]-3,3,3-trifluoro-2-hydroxypropanoate
| Molecular Formula | C15H18F3NO5 |
|---|---|
| Molecular Weight | 349.11 g/mol |
| LogP | 2.5923 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.1137 |
| Heavy Atoms | 24 |
| Complexity | 587.76746 |
Chemical Identifiers
| CAS Number | 294196-50-2 |
|---|---|
| SMILES | CCN(C1=CC=C(C=C1)C(C(=O)OC)(C(F)(F)F)O)C(=O)OCC |
Product Overview
BAS 00674291 (CAS 294196-50-2), with molecular formula C15H18F3NO5 and molecular weight 349.11 g/mol. IUPAC: methyl 2-[4-[ethoxycarbonyl(ethyl)amino]phenyl]-3,3,3-trifluoro-2-hydroxypropanoate.
Chemical Property Profile of BAS 00674291
Property Insights of BAS 00674291
The XLogP value of 2.5923 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00674291. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00674291. Following Lipinski's Rule of Five, BAS 00674291 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 00674291?
The CAS number of BAS 00674291 is 294196-50-2.
What is the molecular formula of BAS 00674291?
The molecular formula of BAS 00674291 is C15H18F3NO5.
What is the molecular weight of BAS 00674291?
The molecular weight of BAS 00674291 is 349.11 g/mol.
Where can I buy BAS 00674291?
You can request a quote for BAS 00674291 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00674291?
Yes, KEHONG BIO provides custom synthesis services for BAS 00674291 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.