Ralimetinib
5-[2-tert-butyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]-3-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine
Molecular Identity
Ralimetinib
5-[2-tert-butyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]-3-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine
PubChem CID: 11539025
2D Structure
Properties
C24H29FN6
Molecular Formula
420.50
Molecular Weight
g/mol
420.2438
Exact Mass
Da
5.3
XLogP
Above Lipinski threshold
85.4
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
5
H-Bond Acceptors
608
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)(C)CN1C2=C(C=CC(=N2)C3=C(N=C(N3)C(C)(C)C)C4=CC=C(C=C4)F)N=C1NIsomeric SMILES
SMILES: CC(C)(C)CN1C2=C(C=CC(=N2)C3=C(N=C(N3)C(C)(C)C)C4=CC=C(C=C4)F)N=C1NSynonyms(20)
Ralimetinib862505-00-8LY-2228820 free baseLY2228820 free base73I34XW4HDLSN2322600 FREE BASELSN-2322600 FREE BASE5-[2-(1,1-dimethylethyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]-3-(2,2-dimethylpropyl)-3H-Imidazo[4,5-b]pyridin-2-amineDTXSID002354563H-Imidazo(4,5-b)pyridin-2-amine, 5-(2-(1,1-dimethylethyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)-3-(2,2-dimethylpropyl)-ralimetinibum5-(2-(1,1-Dimethylethyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)-3-(2,2-dimethylpropyl)-3H-imidazo(4,5-b)pyridin-2-amine5-(2-tert-butyl-5-(4-fluorophenyl)-3H-imidazol-4-yl)-3-(2,2-dimethylpropyl)imidazo(5,4-b)pyridin-2-amine5-[2-tert-butyl-5-(4-fluorophenyl)-3H-imidazol-4-yl]-3-(2,2-dimethylpropyl)imidazo[5,4-b]pyridin-2-amineRefChem:930547
Data from PubChem (NCBI)
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