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5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide structure
Fine Chemical

5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide

TL;DR: 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide (CAS 1005127-46-7) is a chemical compound with molecular formula C16H14F3NO3 and molecular weight 325.0926 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxamide

Also Known As: 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide, 2-oxo-N-[3-(trifluoromethyl)phenyl]hexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxamide, 2-oxo-N-(3-(trifluoromethyl)phenyl)hexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxamide, 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxamide

CAS Number
1005127-46-7
Molecular Formula
C16H14F3NO3
Molecular Weight
325.0926 g/mol
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Technical Specifications

Molecular FormulaC16H14F3NO3
Molecular Weight325.0926 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)55.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds2
Exact Mass325.0926 Da
Heavy Atoms23
Complexity535.0
SMILESC1C2CC3C1C(C2C(=O)NC4=CC=CC(=C4)C(F)(F)F)C(=O)O3
InChIKeyGZIYDTRUFINXAO-UHFFFAOYSA-N

Chemical Property Profile of 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide

XLogP
2.4
TPSA (Topological Polar Surface Area)
55.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
2
Heavy Atoms
23
Complexity
535.0
Exact Mass
325.0926
Monoisotopic Mass
325.0926
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 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide

The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide. With a topological polar surface area (TPSA) of 55.4 Ų, 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide 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 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide?

The CAS number of 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide is 1005127-46-7.

What is the molecular formula of 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide?

The molecular formula of 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide is C16H14F3NO3.

What is the molecular weight of 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide?

The molecular weight of 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide is 325.0926 g/mol.

Where can I buy 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide?

You can request a quote for 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide?

Yes, CoreyChem provides custom synthesis services for 5-oxo-N-[3-(trifluoromethyl)phenyl]-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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