(2-((2,5-Dichloropyrimidin-4-yl)amino)phenyl)dimethylphosphine oxide

C12H12Cl2N3OPCAS 1197953-49-3316.12 g/mol

Open in Covalent MOL file
PONHNNClCl
Aryl halideSecondary amine

Properties

Molecular formula
C12H12Cl2N3OP
Molar mass
316.12 g/mol
Exact mass
315.0095 Da
logP
3.78Crippen estimate
Polar surface area
54.9 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, P501

Identifiers

CAS number
1197953-49-3
SMILES
CP(=O)(C)C1=CC=CC=C1NC2=NC(=NC=C2Cl)Cl
InChIKey
XIKUAKVCJMVXCI-UHFFFAOYSA-N
InChI
InChI=1S/C12H12Cl2N3OP/c1-19(2,18)10-6-4-3-5-9(10)16-11-8(13)7-15-12(14)17-11/h3-7H,1-2H3,(H,15,16,17)

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Names and synonyms

1 names
  • 2,5-Dichloro-N-(2-(dimethylphosphoryl)phenyl)pyrimidin-4-amine

Work with (2-((2,5-Dichloropyrimidin-4-yl)amino)phenyl)dimethylphosphine oxide

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Similar compounds

2,5-Dichloro-N-(2-(isopropylthio)phenyl)pyrimidin-4-amine1632485-14-356 % similar Brigatinib1197953-54-047 % similar (2-Aminophenyl)dimethylphosphine oxide1197953-47-135 % similar 5-Chloro-N2-(4-(4-(dimethylamino)-1-piperidinyl)-2-methoxyphenyl)-N4-(2-(dimethylphosphinyl)phenyl)-2,4-pyrimidinediamine1197958-12-533 % similar 2,4,5-Trichloropyrimidine5750-76-532 % similar 2,5-Dichloropyrimidin-4-amine89180-51-830 % similar 2-((5-Chloro-2-((2-methoxy-4-morpholin-4-ylphenyl)amino)pyrimidin-4-yl)amino)-N-methylbenzamide761437-28-930 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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