Dirozalkib
5-chloro-2-N-(6-methyl-5-piperidin-4-yl-2,3-dihydro-1,4-benzodioxin-8-yl)-4-N-(2-propan-2-ylsulfonylphenyl)pyrimidine-2,4-diamine
Molecular Identity
Dirozalkib
5-chloro-2-N-(6-methyl-5-piperidin-4-yl-2,3-dihydro-1,4-benzodioxin-8-yl)-4-N-(2-propan-2-ylsulfonylphenyl)pyrimidine-2,4-diamine
PubChem CID: 121260977
2D Structure
Properties
C27H32ClN5O4S
Molecular Formula
558.10
Molecular Weight
g/mol
557.1864
Exact Mass
Da
5.4
XLogP
Above Lipinski threshold
123
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
9
H-Bond Acceptors
870
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(17)
Dirozalkib1893419-37-8dirozalkib [INN]2FH56C28YTorb3028827SCHEMBL17659170SCHEMBL30614623SCHEMBL30614624GTPL13811XZP3621XZP-3621compound 3 [WO2016050171A1]T2062972,4-Pyrimidinediamine, 5-chloro-2-[2,3-dihydro-7-methyl-8-(4-piperidinyl)-1,4-benzodioxin-5-yl]-N4-[2-[(1-methylethyl)sulfonyl]phenyl]-5-chloro-2-N-(6-methyl-5-piperidin-4-yl-2,3-dihydro-1,4-benzodioxin-8-yl)-4-N-(2-propan-2-ylsulfonylphenyl)pyrimidine-2,4-diamine
Data from PubChem (NCBI)
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