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(5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione structure
Fine Chemical

(5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione

TL;DR: (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione (CAS 579442-19-6) is a chemical compound with molecular formula C23H17FIN3O3 and molecular weight 529.02985 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione

Also Known As: (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione, (5Z)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-6-hydroxy-3-(4-iodophenyl)pyrimidine-2,4(3H,5H)-dione, (Z)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(4-iodophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

CAS Number
579442-19-6
Molecular Formula
C23H17FIN3O3
Molecular Weight
529.02985 g/mol
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Technical Specifications

Molecular FormulaC23H17FIN3O3
Molecular Weight529.02985 g/mol
XLogP4.7
Topological Polar Surface Area (TPSA)71.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds3
Exact Mass529.02985 Da
Heavy Atoms31
Complexity759.0
SMILESCC1=CC(=C(N1C2=CC=C(C=C2)F)C)/C=C\3/C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)I
InChIKeyMLCSWCKEKJTMRN-NDENLUEZSA-N

Chemical Property Profile of (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione

XLogP
4.7
TPSA (Topological Polar Surface Area)
71.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
31
Complexity
759.0
Exact Mass
529.02985
Monoisotopic Mass
529.02985
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 (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione

The XLogP value of 4.7 indicates that (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione?

The CAS number of (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione is 579442-19-6.

What is the molecular formula of (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione?

The molecular formula of (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione is C23H17FIN3O3.

What is the molecular weight of (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione?

The molecular weight of (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione is 529.02985 g/mol.

Where can I buy (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione?

You can request a quote for (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione?

Yes, CoreyChem provides custom synthesis services for (5Z)-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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