![(2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide structure](/static/products/117/1173678-08-4.webp)
(2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
TL;DR: (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide (CAS 1173678-08-4) is a chemical compound with molecular formula C17H13F3N4O2 and molecular weight 362.09906 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-(4-oxo-1,2,3-benzotriazin-3-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
Also Known As: (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide, (S)-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)-N-(3-(trifluoromethyl)phenyl)propanamide
Technical Specifications
| Molecular Formula | C17H13F3N4O2 |
| Molecular Weight | 362.09906 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 74.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.09906 Da |
| Heavy Atoms | 26 |
| Complexity | 581.0 |
| SMILES | C[C@@H](C(=O)NC1=CC=CC(=C1)C(F)(F)F)N2C(=O)C3=CC=CC=C3N=N2 |
| InChIKey | XRWXOLVPBIUZRB-JTQLQIEISA-N |
Chemical Property Profile of (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
Property Insights of (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
The XLogP value of 3.8 indicates that (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide. Following Lipinski's Rule of Five, (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
The CAS number of (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide is 1173678-08-4.
What is the molecular formula of (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
The molecular formula of (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide is C17H13F3N4O2.
What is the molecular weight of (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
The molecular weight of (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide is 362.09906 g/mol.
Where can I buy (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
You can request a quote for (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
Yes, CoreyChem provides custom synthesis services for (2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.