Ccx-354
1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-[3-(1H-imidazol-2-yl)pyrazolo[5,4-b]pyridin-1-yl]ethanone
Molecular Identity
Ccx-354
1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-[3-(1H-imidazol-2-yl)pyrazolo[5,4-b]pyridin-1-yl]ethanone
PubChem CID: 135565361
2D Structure
Properties
C22H22ClN7O2
Molecular Formula
451.90
Molecular Weight
g/mol
451.1524
Exact Mass
Da
2.5
XLogP
Drug-like (Lipinski: < 5)
92.2
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
6
H-Bond Acceptors
650
Complexity
SMILES
Canonical SMILES
SMILES: COC1=C(C=CC(=C1)N2CCN(CC2)C(=O)CN3C4=C(C=CC=N4)C(=N3)C5=NC=CN5)ClIsomeric SMILES
SMILES: COC1=C(C=CC(=C1)N2CCN(CC2)C(=O)CN3C4=C(C=CC=N4)C(=N3)C5=NC=CN5)ClSynonyms(20)
CCX3541010073-75-2CCX-35422PQS5K5TYEthanone, 1-(4-(4-chloro-3-methoxyphenyl)-1-piperazinyl)-2-(3-(1H-imidazol-2-yl)-1H-pyrazolo(3,4-b)pyridin-1-yl)-CCX-354-CUNII-22PQS5K5TYCCX 3541-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-(3-imidazol-2-ylidene-2H-pyrazolo[3,4-b]pyridin-1-yl)ethanone1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-[3-(1h-imidazol-2-yl)-1h-pyrazolo[3,4-b]pyridin-1-yl]ethan-1-one1-(4-(4-chloro-3-methoxyphenyl)piperazin-1-yl)-2-(3-(1H-imidazol-2-yl)-1H-pyrazolo(3,4-b)pyridin-1-yl)ethan-1-one1-(4-(4-chloro-3-methoxyphenyl)piperazin-1-yl)-2-(3-imidazol-2-ylidene-2H-pyrazolo(3,4-b)pyridin-1-yl)ethanoneRefChem:124104GSK-2941266CCX354-C
Data from PubChem (NCBI)
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