2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid - 5-amino-1-[3,5-dichloro-4-(4-chlorobenzoyl)benzyl]-1H-1,2,3-triazole-4-carboxamide (1:1)

Basic Information

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CAS Number

187739-60-2

Molecular Formula

C22H16Cl3N7O6

Molecular Weight

580.77 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Amines

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

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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O=C(c1nnn(c1N)Cc3cc(Cl)c(C(=O)c2ccc(Cl)cc2)c(Cl)c3)N.O=C1\C=C(\C(=O)O)NC(=O)N1

InChI

InChI=1S/C17H12Cl3N5O2.C5H4N2O4/c18-10-3-1-9(2-4-10)15(26)13-11(19)5-8(6-12(13)20)7-25-16(21)14(17(22)27)23-24-25;8-3-1-2(4(9)10)6-5(11)7-3/h1-6H,7,21H2,(H2,22,27);1H,(H,9,10)(H2,6,7,8,11)

InChIKey

MNWOBDDXRRBONM-UHFFFAOYSA-N

LogP

1.960099999999999

Topological Polar Surface Area

219.90999999999997 Å²

Hydrogen Bond Donor/Acceptor

7 / 13

Complexity

773

Synonyms & References

English

Carboxiamidotriazol orotate
SB17292
5-Amino-1-[[3,5-dichloro-4-(4-chlorobenzoyl)phenyl]methyl]triazole-4-carboxamide;2,4-dioxo-1H-pyrimi
Carboxyamidotriazole (Orotate)
L-651582 (Orotate);CAI (Orotate)
Carboxyamidotriazole Orotate
L-651582 Orotate
CAI Orotate
OCSMDRBVJRAMCI-UHFFFAOYSA-N
CARBOXYAMIDOTRIAZOLE OROTATE

MDL Number

MFCD22572756

FAQ

What is 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid - 5-amino-1-[3,5-dichloro-4-(4-chlorobenzoyl)benzyl]-1H-1,2,3-triazole-4-carboxamide (CAS: 187739-60-2)?

This compound is a complex organic molecule used primarily in pharmaceutical research and development. It features a pyrimidine backbone with a 1,2,3-triazole ring and a carboxamide group, making it suitable for various medicinal and chemical applications.

What are the main uses of 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid - 5-amino-1-[3,5-dichloro-4-(4-chlorobenzoyl)benzyl]-1H-1,2,3-triazole-4-carboxamide (CAS: 187739-60-2)?

This compound is mainly used in the pharmaceutical industry for research and development of new drugs. It can also be utilized in organic synthesis and as a precursor for other medicinal compounds.

Is 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid - 5-amino-1-[3,5-dichloro-4-(4-chlorobenzoyl)benzyl]-1H-1,2,3-triazole-4-carboxamide (CAS: 187739-60-2) safe?

The compound is generally safe when handled with appropriate precautions. Users should avoid contact with skin and eyes, and ensure proper ventilation. Protective equipment such as gloves and safety glasses are recommended.

How should 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid - 5-amino-1-[3,5-dichloro-4-(4-chlorobenzoyl)benzyl]-1H-1,2,3-triazole-4-carboxamide (CAS: 187739-60-2) be stored?

Store the compound in a cool, dry place away from direct sunlight and heat sources. Keep it in a tightly sealed container to protect it from moisture and air. Ideally, store it at room temperature (15-25°C) and avoid exposure to temperatures above 30°C.

Related Compounds

1,3-Dibromo-2,4-dichloro-5-fluorobenzene structure

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Compound Q&A

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Compound Q&A

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What is 2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CAS: 1289040-88-5)?

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Compound Q&A

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Compound Q&A

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Compound Q&A

What is 1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (CAS: 794568-90-4)?

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Compound Q&A

What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

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2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid - 5-amino-1-[3,5-dichloro-4-(4-chlorobenzoyl)benzyl]-1H-1,2,3-triazole-4-carboxamide (1:1) | CAS No. 187739-60-2

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Synonyms & References

English

MDL Number

FAQ

What is 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid - 5-amino-1-[3,5-dichloro-4-(4-chlorobenzoyl)benzyl]-1H-1,2,3-triazole-4-carboxamide (CAS: 187739-60-2)?

What are the main uses of 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid - 5-amino-1-[3,5-dichloro-4-(4-chlorobenzoyl)benzyl]-1H-1,2,3-triazole-4-carboxamide (CAS: 187739-60-2)?

Is 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid - 5-amino-1-[3,5-dichloro-4-(4-chlorobenzoyl)benzyl]-1H-1,2,3-triazole-4-carboxamide (CAS: 187739-60-2) safe?

How should 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid - 5-amino-1-[3,5-dichloro-4-(4-chlorobenzoyl)benzyl]-1H-1,2,3-triazole-4-carboxamide (CAS: 187739-60-2) be stored?

Related Compounds

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What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

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