3-Bromo Nevirapine

Base Information

Chemical Name:3-Bromo Nevirapine
CAS No.:284686-21-1
Molecular Formula:C₁₅H₁₃BrN₄O
Molecular Weight:345.198
Hs Code.:
DSSTox Substance ID:DTXSID80443572
Wikidata:Q82261460
Mol file:284686-21-1.mol

Synonyms:3-Bromo Nevirapine;284686-21-1;6-bromo-2-cyclopropyl-7-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-10-one;DTXSID80443572;CS-T-49833;3-Bromo-11-cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one;FT-0663809;J-017103

Suppliers and Price of 3-Bromo Nevirapine

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Usbiological
3-Bromo Nevirapine
2.5mg
$ 446.00

TRC
3-BromoNevirapine
100mg
$ 1060.00

TRC
3-BromoNevirapine
10mg
$ 135.00

Biosynth Carbosynth
3-Bromo nevirapine
5 mg
$ 462.50

Biosynth Carbosynth
3-Bromo nevirapine
1 mg
$ 139.90

Biosynth Carbosynth
3-Bromo nevirapine
2 mg
$ 254.40

Biosynth Carbosynth
3-Bromo nevirapine
10 mg
$ 840.90

Biosynth Carbosynth
3-Bromo nevirapine
25 mg
$ 1529.00

AK Scientific
3-BromoNevirapine
10mg
$ 1185.00

AK Scientific
3-BromoNevirapine
5mg
$ 674.00

Total 2 raw suppliers

Chemical Property of 3-Bromo Nevirapine

Chemical Property:

Boiling Point:450.3±45.0 °C(Predicted)
PKA:11.35±0.20(Predicted)
PSA：61.61000
Density:1.619±0.06 g/cm3(Predicted)
LogP:3.29830
Storage Temp.:-20°C Freezer, Under inert atmosphere
Solubility.:Chloroform (Slightly, Sonicated), Dichloromethane (Slightly), Ethyl Acetate (Sli
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:344.02727
Heavy Atom Count:21
Complexity:430

Purity/Quality:

97% ^*data from raw suppliers

3-Bromo Nevirapine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C2C(=NC=C1Br)N(C3=C(C=CC=N3)C(=O)N2)C4CC4
Uses Intermediate in the preparation of Nevirapine metabolites.

Technology Process of 3-Bromo Nevirapine

There total 7 articles about 3-Bromo Nevirapine 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: 92.7%

: 284686-20-0
2-chloro-N-[5'-bromo-4'-methyl-2'-cyclopropylamino-3'-pyridinyl]-3-pyridinecarboxamide

: 284686-21-1
3-bromo-11-cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one

Guidance literature:: With pyridine; sodium hydride; for 0.5h; Heating;
DOI:10.1002/jhet.5570370203

Reference yield:

: 23056-39-5
2-chloro-3-nitro-4-methylpyridine

: 284686-21-1
3-bromo-11-cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one

Guidance literature:: Multi-step reaction with 5 steps

1: 88 percent / xylene / 48 h / 75 °C

2: 55 percent / H₂ / Raney Ni / ethanol / 4 h / 2068.59 Torr

3: 71 percent / N,N-diisopropylethylamine / ethyl acetate / 18 h / 20 °C

4: 30 percent / potassium acetate; acetic acid; bromine / 1 h / 20 °C

5: 92.7 percent / sodium hydride; pyridine / 0.5 h / Heating

With pyridine; hydrogen; bromine; potassium acetate; sodium hydride; acetic acid; N-ethyl-N,N-diisopropylamine; nickel; In ethanol; ethyl acetate; xylene; 1: Substitution / 2: Reduction / 3: Condensation / 4: Bromination / 5: Cyclization;
DOI:10.1002/jhet.5570370203

Reference yield:

: 284686-17-5
2-(cyclopropylamino)-4-methyl-3-nitropyridine

: 284686-21-1
3-bromo-11-cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one

Guidance literature:: Multi-step reaction with 4 steps

1: 55 percent / H₂ / Raney Ni / ethanol / 4 h / 2068.59 Torr

2: 71 percent / N,N-diisopropylethylamine / ethyl acetate / 18 h / 20 °C

3: 30 percent / potassium acetate; acetic acid; bromine / 1 h / 20 °C

4: 92.7 percent / sodium hydride; pyridine / 0.5 h / Heating

With pyridine; hydrogen; bromine; potassium acetate; sodium hydride; acetic acid; N-ethyl-N,N-diisopropylamine; nickel; In ethanol; ethyl acetate; 1: Reduction / 2: Condensation / 3: Bromination / 4: Cyclization;
DOI:10.1002/jhet.5570370203