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2-chloro-5-fluoro-6-hydrazino-N-methyl-N-(4-pyridinylmethyl)-4-pyrimidinamine

HCID 86636972
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CN(Cc1ccncc1)c1nc(Cl)nc(NN)c1F
InChIKey
NSXYSEDYTFWELT-UHFFFAOYSA-N
Molecular formula
C11H12ClFN6
Average molar mass
282.7 g/mol

Names & identifiers

Preferred name
2-chloro-5-fluoro-6-hydrazino-N-methyl-N-(4-pyridinylmethyl)-4-pyrimidinamine
IUPAC
2-chloro-5-fluoro-6-hydrazinyl-N-methyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine

Names & synonyms

SCHEMBL1190683NSXYSEDYTFWELT-UHFFFAOYSA-N2-chloro-5-fluoro-6-hydrazino-N-methyl-N-(4-pyridinylmethyl)-4-pyrimidinamine

Database identifiers

PubChem CID
86636972

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
80 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
19
Formal charge
0
Complexity
278

Related reactions

3 records
New reaction record
HRID 961617 reaction equation
HRID 961617As productValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1205527 reaction equation
HRID 1205527As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1366518 reaction equation
HRID 1366518As productuspto-grants-2011_02

Compound notes

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