5-(4-p-Tolyl-piperazin-1-ylmethyl)-pyrimidine-2,4-diamine

HCID 21473633
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Basic information

Standard SMILES
Cc1ccc(N2CCN(Cc3cnc(N)nc3N)CC2)cc1
InChIKey
GEYVFIRWZPCQLV-UHFFFAOYSA-N
Molecular formula
C16H22N6
Average molar mass
298.39 g/mol

Names & identifiers

Preferred name
5-(4-p-Tolyl-piperazin-1-ylmethyl)-pyrimidine-2,4-diamine
IUPAC
5-[[4-(4-methylphenyl)piperazin-1-yl]methyl]pyrimidine-2,4-diamine

Names & synonyms

SCHEMBL7807221GEYVFIRWZPCQLV-UHFFFAOYSA-N5-(4-p-tolyl-piperazin-1-ylmethyl)-pyrimidine-2,4-diamine

Database identifiers

PubChem CID
21473633

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
84.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
22

Related reactions

3 records
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Compound notes

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