cc-223
3-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
Molecular Identity
cc-223
3-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
PubChem CID: 58298316
2D Structure
Properties
C21H27N5O3
Molecular Formula
397.50
Molecular Weight
g/mol
397.2114
Exact Mass
Da
1.1
XLogP
Drug-like (Lipinski: < 5)
100
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
7
H-Bond Acceptors
581
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
cc-223CC223CC 223compound 37 [PMID: 26083478]1402453-64-8compound 37 (PMID: 26083478)7-(6-(2-hydroxypropan-2-yl)pyridin-3-yl)-1-((1r,4r)-4-methoxycyclohexyl)-1H,2H,3H,4H-pyrazino(2,3-b)(1,4)diazin-2-one7-[6-(2-hydroxypropan-2-yl)pyridin-3-yl]-1-[(1r,4r)-4-methoxycyclohexyl]-1H,2H,3H,4H-pyrazino[2,3-b][1,4]diazin-2-oneRefChem:200092onatasertib (proposed INN)CC04822237-(6-(2-hydroxypropan-2-yl)pyridin-3-yl)-1-(4-methoxycyclohexyl)-3,4-dihydropyrazino(2,3-b)pyrazin-2(1H)-one1228013-30-6OnatasertibATG-008
Data from PubChem (NCBI)
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