BAS 00674271
TL;DR: BAS 00674271 (CAS 294196-65-9) 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 3,3,3-trifluoro-2-hydroxy-2-[4-[methyl(propan-2-yloxycarbonyl)amino]phenyl]propanoate
Also Known As: BAS 00674271, methyl 3,3,3-trifluoro-2-hydroxy-2-{4-[(isopropoxycarbonyl)(methyl)amino]phenyl}propanoate, methyl 3,3,3-trifluoro-2-hydroxy-2-(4-{methyl[(propan-2-yloxy)carbonyl]amino}phenyl)propanoate, methyl 3,3,3-trifluoro-2-hydroxy-2-[4-[methyl(propan-2-yloxycarbonyl)amino]phenyl]propanoate, methyl 3,3,3-trifluoro-2-hydroxy-2-(4-((isopropoxycarbonyl)(methyl)amino)phenyl)propanoate
| Molecular Formula | C15H18F3NO5 |
|---|---|
| Molecular Weight | 349.11 g/mol |
| LogP | 2.5907 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 349.1137 |
| Heavy Atoms | 24 |
| Complexity | 600.12225 |
Chemical Identifiers
| CAS Number | 294196-65-9 |
|---|---|
| SMILES | CC(C)OC(=O)N(C)C1=CC=C(C=C1)C(C(=O)OC)(C(F)(F)F)O |
Product Overview
BAS 00674271 (CAS 294196-65-9), with molecular formula C15H18F3NO5 and molecular weight 349.11 g/mol. IUPAC: methyl 3,3,3-trifluoro-2-hydroxy-2-[4-[methyl(propan-2-yloxycarbonyl)amino]phenyl]propanoate.
Chemical Property Profile of BAS 00674271
Property Insights of BAS 00674271
The XLogP value of 2.5907 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00674271. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00674271. Following Lipinski's Rule of Five, BAS 00674271 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 00674271?
The CAS number of BAS 00674271 is 294196-65-9.
What is the molecular formula of BAS 00674271?
The molecular formula of BAS 00674271 is C15H18F3NO5.
What is the molecular weight of BAS 00674271?
The molecular weight of BAS 00674271 is 349.11 g/mol.
Where can I buy BAS 00674271?
You can request a quote for BAS 00674271 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00674271?
Yes, KEHONG BIO provides custom synthesis services for BAS 00674271 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.