Cdk2-IN-37
2'-[(5-ethoxy-1H-pyrazol-4-yl)amino]-7'-[(1R,3R)-3-hydroxycyclohexyl]spiro[cyclopropane-1,5'-pyrrolo[2,3-d]pyrimidine]-6'-one
Molecular Identity
Cdk2-IN-37
2'-[(5-ethoxy-1H-pyrazol-4-yl)amino]-7'-[(1R,3R)-3-hydroxycyclohexyl]spiro[cyclopropane-1,5'-pyrrolo[2,3-d]pyrimidine]-6'-one
PubChem CID: 172269291
2D Structure
Properties
C19H24N6O3
Molecular Formula
384.40
Molecular Weight
g/mol
384.1910
Exact Mass
Da
1.4
XLogP
Drug-like (Lipinski: < 5)
116
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
7
H-Bond Acceptors
602
Complexity
SMILES
Canonical SMILES
SMILES: CCOC1=C(C=NN1)NC2=NC=C3C(=N2)N(C(=O)C34CC4)C5CCCC(C5)OIsomeric SMILES
SMILES: CCOC1=C(C=NN1)NC2=NC=C3C(=N2)N(C(=O)C34CC4)[C@@H]5CCC[C@H](C5)OSynonyms(18)
CDK2-IN-373054692-62-2NVP-ECI830NVP-ECI-830ECI830orb2945253SCHEMBL31074418GTPL14487ECI-830YQF2785BDBM702224EX-A16498US20240360137, Example 23example 23 [US20240360137]HY-170442
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Cdk2-IN-37
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