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(2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide structure
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(2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide

TL;DR: (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide (CAS 1173679-47-4) is a chemical compound with molecular formula C18H14F3N3O2 and molecular weight 361.10382 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2S)-2-(4-oxoquinazolin-3-yl)-N-[4-(trifluoromethyl)phenyl]propanamide

Also Known As: (2S)-2-(4-oxoquinazolin-3-yl)-N-[4-(trifluoromethyl)phenyl]propanamide, (S)-2-(4-oxoquinazolin-3(4H)-yl)-N-(4-(trifluoromethyl)phenyl)propanamide, (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide

CAS Number
1173679-47-4
Molecular Formula
C18H14F3N3O2
Molecular Weight
361.10382 g/mol
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Technical Specifications

Molecular FormulaC18H14F3N3O2
Molecular Weight361.10382 g/mol
XLogP3.1
Topological Polar Surface Area (TPSA)61.8 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds3
Exact Mass361.10382 Da
Heavy Atoms26
Complexity571.0
SMILESC[C@@H](C(=O)NC1=CC=C(C=C1)C(F)(F)F)N2C=NC3=CC=CC=C3C2=O
InChIKeyYKOMHUUGWZIXCY-NSHDSACASA-N

Chemical Property Profile of (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide

XLogP
3.1
TPSA (Topological Polar Surface Area)
61.8
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
3
Heavy Atoms
26
Complexity
571.0
Exact Mass
361.10382
Monoisotopic Mass
361.10382
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide

The XLogP value of 3.1 indicates that (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide. Following Lipinski's Rule of Five, (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide has 1 hydrogen bond donor(s) and 6 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-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide?

The CAS number of (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide is 1173679-47-4.

What is the molecular formula of (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide?

The molecular formula of (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide is C18H14F3N3O2.

What is the molecular weight of (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide?

The molecular weight of (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide is 361.10382 g/mol.

Where can I buy (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide?

You can request a quote for (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(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-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide?

Yes, CoreyChem provides custom synthesis services for (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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