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F1168-0240 structure
Fine Chemical

F1168-0240

TL;DR: F1168-0240 (CAS 1005244-96-1) is a chemical compound with molecular formula C27H24ClF3N2O5 and molecular weight 548.13257 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-benzoyl-4-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-6-hydroxy-1-methyl-6-(trifluoromethyl)-1,3-diazinan-2-one

Also Known As: F1168-0240, AF-399/41181697, 5-benzoyl-4-(4-((4-chlorobenzyl)oxy)-3-methoxyphenyl)-6-hydroxy-1-methyl-6-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one, 5-benzoyl-4-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-6-hydroxy-1-methyl-6-(trifluoromethyl)-1,3-diazinan-2-one, 5-benzoyl-4-{4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}-6-hydroxy-1-methyl-6-(trifluoromethyl)-1,3-diazinan-2-one

CAS Number
1005244-96-1
Molecular Formula
C27H24ClF3N2O5
Molecular Weight
548.13257 g/mol
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Technical Specifications

Molecular FormulaC27H24ClF3N2O5
Molecular Weight548.13257 g/mol
XLogP5.2
Topological Polar Surface Area (TPSA)88.1 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors8
Rotatable Bonds7
Exact Mass548.13257 Da
Heavy Atoms38
Complexity834.0
SMILESCN1C(=O)NC(C(C1(C(F)(F)F)O)C(=O)C2=CC=CC=C2)C3=CC(=C(C=C3)OCC4=CC=C(C=C4)Cl)OC
InChIKeyIXCDORJIRFWWHW-UHFFFAOYSA-N

Chemical Property Profile of F1168-0240

XLogP
5.2
TPSA (Topological Polar Surface Area)
88.1
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
8
Rotatable Bonds
7
Heavy Atoms
38
Complexity
834.0
Exact Mass
548.13257
Monoisotopic Mass
548.13257
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 F1168-0240

The XLogP value of 5.2 indicates that F1168-0240 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for F1168-0240. Following Lipinski's Rule of Five, F1168-0240 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of F1168-0240?

The CAS number of F1168-0240 is 1005244-96-1.

What is the molecular formula of F1168-0240?

The molecular formula of F1168-0240 is C27H24ClF3N2O5.

What is the molecular weight of F1168-0240?

The molecular weight of F1168-0240 is 548.13257 g/mol.

Where can I buy F1168-0240?

You can request a quote for F1168-0240 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for F1168-0240?

Yes, CoreyChem provides custom synthesis services for F1168-0240 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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