4-(2-Bromo-6-pyrrolidin-1-ylpyridine-4-sulfonyl)phenylamine

Base Information

Chemical Name:4-(2-Bromo-6-pyrrolidin-1-ylpyridine-4-sulfonyl)phenylamine
CAS No.:231286-79-6
Molecular Formula:C₁₅H₁₆BrN₃O₂S
Molecular Weight:382.281
Hs Code.:
Nikkaji Number:J1.996.693C
Pharos Ligand ID:9UW1W1UAPDBS
ChEMBL ID:CHEMBL23038

Synonyms:4-(2-bromo-6-pyrrolidin-1-yl-pyridine-4-sulfonyl)phenylamine;4-(2-bromo-6-pyrrolidin-1-ylpyridine-4-sulfonyl)phenylamine;4-BrPPSO2-phenylamine;Ro 66-0074

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 4-(2-Bromo-6-pyrrolidin-1-ylpyridine-4-sulfonyl)phenylamine

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:381.01466
Heavy Atom Count:22
Complexity:468

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CCN(C1)C2=NC(=CC(=C2)S(=O)(=O)C3=CC=C(C=C3)N)Br

Technology Process of 4-(2-Bromo-6-pyrrolidin-1-ylpyridine-4-sulfonyl)phenylamine

There total 7 articles about 4-(2-Bromo-6-pyrrolidin-1-ylpyridine-4-sulfonyl)phenylamine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 93.0%

: 123-75-1
pyrrolidine

: 231286-73-0
4-(2,6-dibromopyridine-4-sulphonyl)-phenylamine

: 231286-79-6
4-(2-bromo-6-pyrrolidine-1-yl-pyridine-4-sulphonyl)-phenylamine

Guidance literature:: In 1,4-dioxane; at 20 ℃; for 4h;
DOI:10.1021/jm021085c

Reference yield:

: 175422-04-5
2,6-dibromo-4-nitropyridine

: 231286-79-6
4-(2-bromo-6-pyrrolidine-1-yl-pyridine-4-sulphonyl)-phenylamine

Guidance literature:: Multi-step reaction with 4 steps

1: 81 percent / dimethylformamide / 3 h / 20 °C

2: 87 percent / meta-chloroperbenzoic acid / CH₂Cl₂ / 2 h / 20 °C

3: 80 percent / Fe; NH₄Cl / methanol; dioxane; H₂O / 1.5 h / Heating

4: 93 percent / dioxane / 4 h / 20 °C

With iron; ammonium chloride; 3-chloro-benzenecarboperoxoic acid; In 1,4-dioxane; methanol; dichloromethane; water; N,N-dimethyl-formamide;
DOI:10.1021/jm021085c

Reference yield:

: 626-05-1
2,6-Dibromopyridine

: 231286-79-6
4-(2-bromo-6-pyrrolidine-1-yl-pyridine-4-sulphonyl)-phenylamine

Guidance literature:: Multi-step reaction with 7 steps

1: 79 percent / aq. H₂O₂; CF₃COOH / 3 h / 100 °C

2: 80 percent / HNO₃; H₂SO₄ / 1.5 h / 100 °C

3: 99 percent / PBr₃ / acetonitrile / 14 h / Heating

4: 81 percent / dimethylformamide / 3 h / 20 °C

5: 87 percent / meta-chloroperbenzoic acid / CH₂Cl₂ / 2 h / 20 °C

6: 80 percent / Fe; NH₄Cl / methanol; dioxane; H₂O / 1.5 h / Heating

7: 93 percent / dioxane / 4 h / 20 °C

With sulfuric acid; dihydrogen peroxide; nitric acid; phosphorus tribromide; iron; ammonium chloride; 3-chloro-benzenecarboperoxoic acid; trifluoroacetic acid; In 1,4-dioxane; methanol; dichloromethane; water; N,N-dimethyl-formamide; acetonitrile;
DOI:10.1021/jm021085c