Molecular Identity
Mci-186
5-methyl-2-phenyl-4H-pyrazol-3-one
PubChem CID: 4021
Edaravone is a pyrazolone that is 2,4-dihydro-3H-pyrazol-3-one which is substituted at positions 2 and 5 by phenyl and methyl groups, respectively. It has a role as an antioxidant and a radical scavenger.
2D Structure
Properties
C10H10N2O
Molecular Formula
174.20
Molecular Weight
g/mol
174.0793
Exact Mass
Da
1.3
XLogP
Drug-like (Lipinski: < 5)
32.7
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
2
H-Bond Acceptors
241
Complexity
SMILES
Canonical SMILES
SMILES: CC1=NN(C(=O)C1)C2=CC=CC=C2Isomeric SMILES
SMILES: CC1=NN(C(=O)C1)C2=CC=CC=C2Synonyms(20)
MCI-186MCI 186RefChem:57584edaravone89-25-83-METHYL-1-PHENYL-2-PYRAZOLIN-5-ONERadicutNorphenazone1-Phenyl-3-methyl-5-pyrazoloneDeveloper ZMethylphenylpyrazoloneNorantipyrineC.I. Developer 1PhenylmethylpyrazolonePhenyl methyl pyrazolone
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Mci-186
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