3-Bromo-5-chloro-2-pyrazinamine

C₄H₃BrClN₃CAS 76537-18-3208.44 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₄H₃BrClN₃
Molar mass: 208.44 g/mol
Exact mass: 206.9199 Da
logP: 1.47Crippen estimate
Polar surface area: 51.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

76537-18-3

SMILES

Nc1ncc(Cl)nc1Br

InChIKey

ACFBUXHJONGLLF-UHFFFAOYSA-N

InChI

InChI=1S/C4H3BrClN3/c5-3-4(7)8-1-2(6)9-3/h1H,(H2,7,8)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names

2-Pyrazinamine, 3-bromo-5-chloro-
Pyrazinamine, 3-bromo-5-chloro-
2-Amino-3-bromo-5-chloropyrazine
3-Bromo-5-chloro-2-aminopyrazine
(3-Bromo-5-chloropyrazin-2-yl)amine
3-Bromo-5-chloropyrazin-2-amine

Work with 3-Bromo-5-chloro-2-pyrazinamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Amino-3,5-dibromopyrazine24241-18-759 % similar 2-Amino-3,5-dichloropyrazine873-42-759 % similar 3-Amino-2-bromo-6-chloropyridine1050501-88-647 % similar 3-Amino-6-chloropyrazine-2-carboxylic acid2727-13-146 % similar 3,6-Dibromopyrazin-2-amine957230-70-544 % similar Methyl 3-amino-6-chloropyrazine-2-carboxylate1458-03-343 % similar 5-Bromopyrazine-2,3-diamine89123-58-042 % similar 3-Bromo-5-chloropyridin-2-amine26163-03-141 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Bromo-4-chloropyrimidin-2-amine1044767-99-8 5-Bromo-6-chloropyrazin-2-amine173253-42-4 4-Amino-5-bromo-2-chloropyrimidine205672-25-9 2-Amino-3-bromo-6-chloropyrazine212779-21-0 2-Amino-5-bromo-3-chloropyrazine21943-13-5 3-Amino-4-bromo-6-chloropyridazine446273-59-2

Elsewhere

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