CDK4/6-IN-21 (maleate)
(Z)-but-2-enedioic acid;N-[4-(3-cyclopropyl-7-fluoro-2-methylbenzimidazol-5-yl)-5-fluoropyrimidin-2-yl]-6-[2-(dimethylamino)ethyl]-7,8-dihydro-5H-1,6-naphthyridin-2-amine
Molecular Identity
CDK4/6-IN-21 (maleate)
(Z)-but-2-enedioic acid;N-[4-(3-cyclopropyl-7-fluoro-2-methylbenzimidazol-5-yl)-5-fluoropyrimidin-2-yl]-6-[2-(dimethylamino)ethyl]-7,8-dihydro-5H-1,6-naphthyridin-2-amine
PubChem CID: 168429476
2D Structure
Properties
C31H34F2N8O4
Molecular Formula
620.60
Molecular Weight
g/mol
620.2671
Exact Mass
Da
150
TPSA
May have limited oral absorption
3
H-Bond Donors
13
H-Bond Acceptors
890
Complexity
SMILES
Canonical SMILES
SMILES: CC1=NC2=C(N1C3CC3)C=C(C=C2F)C4=NC(=NC=C4F)NC5=NC6=C(CN(CC6)CCN(C)C)C=C5.C(=CC(=O)O)C(=O)OIsomeric SMILES
SMILES: CC1=NC2=C(N1C3CC3)C=C(C=C2F)C4=NC(=NC=C4F)NC5=NC6=C(CN(CC6)CCN(C)C)C=C5.C(=C\C(=O)O)\C(=O)OSynonyms(10)
2765997-88-2orb2664524CDK4/6-IN-21 (maleate)SPH4336SPH 4336 [WHO-DD]9X8U786V5TSPH-4336EX-A12491HY-164376AT89012
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to CDK4/6-IN-21 (maleate)
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