3-(1-Methyl-1H-indol-3-yl)-4-{1-[1-(2-pyridinylmethyl)-4-piperidinyl]-1H-indol-3-yl}-1H-pyrrole-2,5-dione

Basic Information

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CAS Number

170364-57-5

Molecular Formula

C32H29N5O2

Molecular Weight

515.62 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

249-261℃

Boiling Point

767.2°C at 760 mmHg

Flash Point

417.8℃

Solubility

DMSO: soluble10mg/mL, clear (warmed)

SMILES

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CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CN(C5=CC=CC=C54)C6CCN(CC6)CC7=CC=CC=N7

InChI

InChI=1S/C32H29N5O2/c1-35-19-25(23-9-2-4-11-27(23)35)29-30(32(39)34-31(29)38)26-20-37(28-12-5-3-10-24(26)28)22-13-16-36(17-14-22)18-21-8-6-7-15-33-21/h2-12,15,19-20,22H,13-14,16-18H2,1H3,(H,34,38,39)

InChIKey

AXRCEOKUDYDWLF-UHFFFAOYSA-N

LogP

4.932300000000004

Topological Polar Surface Area

72.16 Å²

Hydrogen Bond Donor/Acceptor

1 / 7

Complexity

974

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H413 May cause long lasting harmful effects to aquatic life
Hazardous to the aquatic environment, long-term hazard

Synonyms & References

English

J-510442
SCHEMBL678748
CCG-264797
AMY7827
1H-Pyrrole-2,5-dione, 3-(1-methyl-1H-indol-3-yl)-4-(1-(1-(2-pyridinylmethyl)-4-piperidinyl)-1H-indol-3-yl)-
SB16481
3-(1-methyl-1H-indol-3-yl)-4-{1-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-1H-indol-3-yl}-2,5-dihydro-1H-pyrrole-2,5-dione
DB102
AKOS015994764
LY 317615
3-(1-Methyl-1H-indol-3-yl)-4-[1-(1-pyridin-2-ylmethyl-piperidin-4-yl)-1H-indol-3-yl]-pyrrole-2,5-dione
HMS3265N06
HMS3265M05
CHEBI:91368
Tox21_113367
3-(1-Methyl-1H-indol-3-yl)-4-[1-[1-(2-pyridinylmethyl)-4-piperidinyl]-1H-indol-3-yl]-1H-pyrrole-2,5-dione
HMS3748E03
WHO 8426
NCGC00238452-02
BCP02703
DTXCID3024029
3-(1-methyl-1H-indol-3-yl)-4-{1-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-1H-indol-3-yl}-1H-pyrrole-2,5-dione
AC-5900
HMS3265M06
3-(1-Methyl-1H-indol-3-yl)-4-(1-(1-(pyridin-2-ylmethyl)piperidin-4-yl)-1H-indol-3-yl)-1H-pyrrole-2,5-dione
NSC-767124
FT-0667873
ENZASTAURIN [MI]
3-(1-methylindol-3-yl)-4-[1-[1-(pyridin-2-ylmethyl)piperidin-4-yl]indol-3-yl]pyrrole-2,5-dione
MFCD11040980
EX-A1055

MDL Number

MFCD11040980

Customs Code

2933990090

FAQ

What regulatory guidelines apply to 3-(1-Methyl-1H-indol-3-yl)-4-{1-[1-(2-pyridinylmethyl)-4-piperidinyl]-1H-indol-3-yl}-1H-pyrrole-2,5-dione (CAS: 170364-57-5)?

This compound (CAS: 170364-57-5) may be regulated under GHS for classification and labeling, REACH for registration, evaluation, and authorization, and FDA/EPA guidelines for safety and environmental impact. Specific regulations may vary based on the intended use and jurisdiction.

Are there alternatives to 3-(1-Methyl-1H-indol-3-yl)-4-{1-[1-(2-pyridinylmethyl)-4-piperidinyl]-1H-indol-3-yl}-1H-pyrrole-2,5-dione in synthesis?

Alternative reagents for synthesis include various indoles, pyridines, and piperidines. Analogous compounds such as 3-(1-methylindol-3-yl)-1H-pyrrole-2,5-dione and 4-(1H-indol-3-yl)-1-(2-pyridinylmethyl)-4-piperidinone may serve as effective substitutes.

What is the market or research trend for 3-(1-Methyl-1H-indol-3-yl)-4-{1-[1-(2-pyridinylmethyl)-4-piperidinyl]-1H-indol-3-yl}-1H-pyrrole-2,5-dione (CAS: 170364-57-5)?

There is growing interest in this compound for its potential applications in organic synthesis and pharmaceuticals. Research is focusing on its use as a building block for complex molecules and its biological activity. Market trends suggest increasing demand due to its unique structural features and potential biomedical applications.

How should waste containing 3-(1-Methyl-1H-indol-3-yl)-4-{1-[1-(2-pyridinylmethyl)-4-piperidinyl]-1H-indol-3-yl}-1H-pyrrole-2,5-dione (CAS: 170364-57-5) be handled?

Waste should be collected in suitable containers and stored properly to prevent spills. For disposal, incineration or professional waste disposal services should be utilized. Environmental precautions include ensuring proper containment to prevent contamination of soil and water. Compliance with local regulations is essential.