Molecular Identity
Pyrimethamine
5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine
PubChem CID: 4993
Pyrimethamine can cause developmental toxicity according to state or federal government labeling requirements.
2D Structure
Properties
C12H13ClN4
Molecular Formula
248.71
Molecular Weight
g/mol
248.0829
Exact Mass
Da
2.7
XLogP
Drug-like (Lipinski: < 5)
77.8
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
4
H-Bond Acceptors
243
Complexity
SMILES
Canonical SMILES
SMILES: CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)ClIsomeric SMILES
SMILES: CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)ClSynonyms(20)
pyrimethamine58-14-0DaraprimChloridine5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamineChloridinDiaminopyritaminEthylpyrimidinePirimecidanPirimetaminPirimetaminaChloridynDarachlorErbaprelinaKhloridin
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Pyrimethamine
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