4-[3-(4-Chlorophenyl)-2,1-benzisoxazol-5-yl]pyrimidin-2-amine
4-[3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-amine
Molecular Identity
4-[3-(4-Chlorophenyl)-2,1-benzisoxazol-5-yl]pyrimidin-2-amine
4-[3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-amine
PubChem CID: 2765355
2D Structure
Properties
C17H11ClN4O
Molecular Formula
322.70
Molecular Weight
g/mol
322.0621
Exact Mass
Da
3.6
XLogP
Drug-like (Lipinski: < 5)
77.8
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
404
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC(=CC=C1C2=C3C=C(C=CC3=NO2)C4=NC(=NC=C4)N)ClIsomeric SMILES
SMILES: C1=CC(=CC=C1C2=C3C=C(C=CC3=NO2)C4=NC(=NC=C4)N)ClSynonyms(20)
4-[3-(4-chlorophenyl)-2,1-benzisoxazol-5-yl]pyrimidin-2-amine4-(3-(4-chlorophenyl)-2,1-benzisoxazol-5-yl)pyrimidin-2-amineRefChem:512964PIM-1 INHIBITOR 2477845-12-8PIM1-IN-24-[3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-aminePIM 1 Inhibitor 2Pim1 inhibitor 2QJ8ZMA6BSLUNII-QJ8ZMA6BSLbenzisoxazole-pyrimidine, 2HMS3229J19HMS3414A13AKOS005074822
Data from PubChem (NCBI)
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Molecular Structure
4-[3-(4-Chlorophenyl)-2,1-benzisoxazol-5-yl]pyrimidin-2-amine
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Drug Network
Trials and conditions connected to 4-[3-(4-Chlorophenyl)-2,1-benzisoxazol-5-yl]pyrimidin-2-amine
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