4-{[4-({4-[(E)-2-Cyanovinyl]-2,6-dimethylphenyl}amino)-2-pyrimidinyl]amino}benzonitrile

Basic Information

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CAS Number

500287-72-9

Molecular Formula

C22H18N6

Molecular Weight

366.4 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

245 ºC

Boiling Point

634.1°C at 760 mmHg

Density

1.27

SMILES

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CC1=CC(=CC(=C1NC2=NC(=NC=C2)NC3=CC=C(C=C3)C#N)C)C=CC#N

InChI

InChI=1S/C22H18N6/c1-15-12-18(4-3-10-23)13-16(2)21(15)27-20-9-11-25-22(28-20)26-19-7-5-17(14-24)6-8-19/h3-9,11-13H,1-2H3,(H2,25,26,27,28)/b4-3+

InChIKey

YIBOMRUWOWDFLG-ONEGZZNKSA-N

LogP

5.13506

Complexity

607

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

RILPIVIRINE [WHO-DD]
4-[[4-[4-[(E)-2-cyanoethenyl]-2,6-dimethylanilino]-2-pyrimidinyl]amino]benzonitrile
EX-A245
DTXCID90120680
Rilpivirine free base
CS-0440
DB08864
RILPIVIRINE (MART.)
RILPIVIRINE [USAN]
4-[[4-[[4-[(1E)-2-Cyanoethenyl]-2,6-dimethylphenyl]amino]-2-pyrimidinyl]amino]benzonitrile
rilpivirinum
KE-0036
4-[[4-[4-[(E)-2-cyanoethenyl]-2,6-dimethylanilino]pyrimidin-2-yl]amino]benzonitrile
Rilpivirine (JAN/USAN/INN)
4-{[4-({4-[(1E)-2-cyanoeth-1-en-1-yl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile
W-202888
4-{4-[4-((E)-2-Cyano-vinyl)-2,6-dimethyl-phenylamino]-pyrimidin-2-ylamino}-benzonitrile
FI96A8X663
RILPIVIRINE [VANDF]
500287-72-9
500287-72-9 (free base)
Rilpivirine Z-Isomer HCl
CCG-268241
SCHEMBL385113
A827939
(E)-4-(4-(4-(2-cyanovinyl)-2,6-dimethylphenylamino)pyrimidin-2-ylamino)benzonitrile
4-((4-((4-((E)-2-cyanoethenyl)-2,6-dimethylphenyl)amino)pyrimidin-2-yl)amino)benzonitrile
TMC 278
CHEBI:68606
T27
4-((4-((4-((1E)-2-Cyanoethenyl)-2,6-dimethylphenyl)amino)-2-pyrimidinyl)amino)benzonitrile

MDL Number

MFCD11046372

Customs Code

2933599090

FAQ

What is 4-{[4-({4-[(E)-2-Cyanovinyl]-2,6-dimethylphenyl}amino)-2-pyrimidinyl]amino}benzonitrile (CAS: 500287-72-9)?

4-{[4-({4-[(E)-2-Cyanovinyl]-2,6-dimethylphenyl}amino)-2-pyrimidinyl]amino}benzonitrile is a complex organic compound with a unique molecular structure. It contains amino, pyrimidine, and benzonitrile functional groups. This compound is primarily used in pharmaceutical and medicinal applications due to its specific biological activity.

What are the main uses of 4-{[4-({4-[(E)-2-Cyanovinyl]-2,6-dimethylphenyl}amino)-2-pyrimidinyl]amino}benzonitrile (CAS: 500287-72-9)?

4-{[4-({4-[(E)-2-Cyanovinyl]-2,6-dimethylphenyl}amino)-2-pyrimidinyl]amino}benzonitrile is mainly used in the pharmaceutical industry for developing new drugs. It shows potential in treating various diseases due to its specific biological activities.

Is 4-{[4-({4-[(E)-2-Cyanovinyl]-2,6-dimethylphenyl}amino)-2-pyrimidinyl]amino}benzonitrile (CAS: 500287-72-9) safe?

4-{[4-({4-[(E)-2-Cyanovinyl]-2,6-dimethylphenyl}amino)-2-pyrimidinyl]amino}benzonitrile is generally safe when handled properly. However, it should be stored away from direct sunlight and kept in a cool, dry place. It is important to use appropriate personal protective equipment (PPE) such as gloves and goggles when handling this compound.

How should 4-{[4-({4-[(E)-2-Cyanovinyl]-2,6-dimethylphenyl}amino)-2-pyrimidinyl]amino}benzonitrile (CAS: 500287-72-9) be stored?

Store 4-{[4-({4-[(E)-2-Cyanovinyl]-2,6-dimethylphenyl}amino)-2-pyrimidinyl]amino}benzonitrile in a cool, dry place, protected from direct sunlight and heat. Keep the compound in a tightly sealed container to ensure its stability. Avoid contact with incompatible substances such as strong acids, bases, and oxidizers. Handle with care to prevent spills or inhalation of dust or fumes.