Ds-7423
1-[(2R)-4-[2-(2-aminopyrimidin-5-yl)-6-morpholin-4-yl-9-(2,2,2-trifluoroethyl)purin-8-yl]-2-methylpiperazin-1-yl]ethanone
Molecular Identity
Ds-7423
1-[(2R)-4-[2-(2-aminopyrimidin-5-yl)-6-morpholin-4-yl-9-(2,2,2-trifluoroethyl)purin-8-yl]-2-methylpiperazin-1-yl]ethanone
PubChem CID: 45378170
2D Structure
Properties
C22H27F3N10O2
Molecular Formula
520.50
Molecular Weight
g/mol
520.2271
Exact Mass
Da
0.9
XLogP
Drug-like (Lipinski: < 5)
131
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
13
H-Bond Acceptors
795
Complexity
SMILES
Canonical SMILES
SMILES: CC1CN(CCN1C(=O)C)C2=NC3=C(N2CC(F)(F)F)N=C(N=C3N4CCOCC4)C5=CN=C(N=C5)NIsomeric SMILES
SMILES: C[C@@H]1CN(CCN1C(=O)C)C2=NC3=C(N2CC(F)(F)F)N=C(N=C3N4CCOCC4)C5=CN=C(N=C5)NSynonyms(20)
DS-7423DS74231-[(2R)-4-[2-(2-aminopyrimidin-5-yl)-6-morpholin-4-yl-9-(2,2,2-trifluoroethyl)purin-8-yl]-2-methylpiperazin-1-yl]ethanone1-((2R)-4-(2-(2-aminopyrimidin-5-yl)-6-morpholin-4-yl-9-(2,2,2-trifluoroethyl)purin-8-yl)-2-methylpiperazin-1-yl)ethanoneRefChem:135864PI3K/mTOR Kinase Inhibitor DS-7423Dual PI3 Kinase/mTOR Inhibitor DS-74231222104-37-1(R)-1-(4-(2-(2-Aminopyrimidin-5-yl)-6-morpholino-9-(2,2,2-trifluoroethyl)-9H-purin-8-yl)-2-methylpiperazin-1-yl)ethan-1-one5-{8-[(3R)-4-Acetyl-3-methylpiperazin-1-yl]-6-morpholin-4-yl-9-(2,2,2-trifluoroethyl)-9H-purin-2-yl}pyrimidin-2-amine1-[(2R)-4-[2-(2-aminopyrimidin-5-yl)-6-(morpholin-4-yl)-9-(2,2,2-trifluoroethyl)-9H-purin-8-yl]-2-methylpiperazin-1-yl]ethan-1-oneSCHEMBL336466orb1304003SCHEMBL31711478GTPL12616
Data from PubChem (NCBI)
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