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2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione structure
Fine Chemical

2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione

TL;DR: 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione (CAS 1025668-21-6) is a chemical compound with molecular formula C19H14N4O2 and molecular weight 330.11166 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione

Also Known As: 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione, 2-(2-(3H-2,3,5-triazolyl)-2-aza-1-(4-methylphenyl)vinyl)indane-1,3-dione, 2-[C-(p-tolyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indane-1,3-dione, 2-[C-(4-methylphenyl)-N-(2H-1,2,4-triazol-3-yl)carbonimidoyl]indene-1,3-dione

CAS Number
1025668-21-6
Molecular Formula
C19H14N4O2
Molecular Weight
330.11166 g/mol
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Technical Specifications

Molecular FormulaC19H14N4O2
Molecular Weight330.11166 g/mol
XLogP3.6
Topological Polar Surface Area (TPSA)88.1 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds3
Exact Mass330.11166 Da
Heavy Atoms25
Complexity544.0
SMILESCC1=CC=C(C=C1)C(=NC2=NC=NN2)C3C(=O)C4=CC=CC=C4C3=O
InChIKeyFVHOHZVQBWBGOQ-UHFFFAOYSA-N

Chemical Property Profile of 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione

XLogP
3.6
TPSA (Topological Polar Surface Area)
88.1
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
3
Heavy Atoms
25
Complexity
544.0
Exact Mass
330.11166
Monoisotopic Mass
330.11166
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 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione

The XLogP value of 3.6 indicates that 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione 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 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione. Following Lipinski's Rule of Five, 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione?

The CAS number of 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione is 1025668-21-6.

What is the molecular formula of 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione?

The molecular formula of 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione is C19H14N4O2.

What is the molecular weight of 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione?

The molecular weight of 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione is 330.11166 g/mol.

Where can I buy 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione?

You can request a quote for 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione?

Yes, CoreyChem provides custom synthesis services for 2-[C-(4-methylphenyl)-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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