2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one

C113H90F5N25O7 — CID 157265028

IUPAC2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one
SMILESCOc1ncc(-c2cccc3cc([C@H](C)Cc4nc(C)ncc4C(F)(F)F)n(-c4ccccc4)c(=O)c23)cn1.[C-]#[N+]c1cnc(C)nc1N[C@@H](C)c1cc2cccc(-c3cnc(C)nc3)c2c(=O)n1-c1cccc(F)c1.[C-]#[N+]c1cnc(C)nc1N[C@@H](C)c1cc2cccc(-c3cnc(OC)nc3)c2c(=O)n1-c1cccc(F)c1.[C-]#[N+]c1cnc(C)nc1N[C@@H](C)c1cc2cccc(-c3cncc(O)c3)c2c(=O)n1-c1ccccc1
InChIInChI=1S/C29H24F3N5O2.C28H22FN7O2.C28H22FN7O.C28H22N6O2/c1-17(12-24-23(29(30,31)32)16-33-18(2)36-24)25-13-19-8-7-11-22(20-14-34-28(39-3)35-15-20)26(19)27(38)37(25)21-9-5-4-6-10-21;1-16(34-26-23(30-3)15-31-17(2)35-26)24-11-18-7-5-10-22(19-13-32-28(38-4)33-14-19)25(18)27(37)36(24)21-9-6-8-20(29)12-21;1-16(34-27-24(30-4)15-33-18(3)35-27)25-11-19-7-5-10-23(20-13-31-17(2)32-14-20)26(19)28(37)36(25)22-9-6-8-21(29)12-22;1-17(32-27-24(29-3)16-31-18(2)33-27)25-13-19-8-7-11-23(20-12-22(35)15-30-14-20)26(19)28(36)34(25)21-9-5-4-6-10-21/h4-11,13-17H,12H2,1-3H3;5-16H,1-2,4H3,(H,31,34,35);5-16H,1-3H3,(H,33,34,35);4-17,35H,1-2H3,(H,31,32,33)/t17-;2*16-;17-/m1000/s1
InChIKeyAXWYVRXKXWBHSR-QNBYXMRVSA-N
MW2005.12 g/mol
LogP22.64
Rot. Bonds22

About 2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one

2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one (PubChem CID 157265028) has the molecular formula C113H90F5N25O7 and a molecular weight of 2005.12 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one.

Molecular Properties

Compound Name2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one
PubChem CID157265028
Molecular FormulaC113H90F5N25O7
Molecular Weight2005.12 g/mol
Exact Mass2003.74
IUPAC Name2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one
SMILESCOc1ncc(-c2cccc3cc([C@H](C)Cc4nc(C)ncc4C(F)(F)F)n(-c4ccccc4)c(=O)c23)cn1.[C-]#[N+]c1cnc(C)nc1N[C@@H](C)c1cc2cccc(-c3cnc(C)nc3)c2c(=O)n1-c1cccc(F)c1.[C-]#[N+]c1cnc(C)nc1N[C@@H](C)c1cc2cccc(-c3cnc(OC)nc3)c2c(=O)n1-c1cccc(F)c1.[C-]#[N+]c1cnc(C)nc1N[C@@H](C)c1cc2cccc(-c3cncc(O)c3)c2c(=O)n1-c1ccccc1
InChIInChI=1S/C29H24F3N5O2.C28H22FN7O2.C28H22FN7O.C28H22N6O2/c1-17(12-24-23(29(30,31)32)16-33-18(2)36-24)25-13-19-8-7-11-22(20-14-34-28(39-3)35-15-20)26(19)27(38)37(25)21-9-5-4-6-10-21;1-16(34-26-23(30-3)15-31-17(2)35-26)24-11-18-7-5-10-22(19-13-32-28(38-4)33-14-19)25(18)27(37)36(24)21-9-6-8-20(29)12-21;1-16(34-27-24(30-4)15-33-18(3)35-27)25-11-19-7-5-10-23(20-13-31-17(2)32-14-20)26(19)28(37)36(25)22-9-6-8-21(29)12-22;1-17(32-27-24(29-3)16-31-18(2)33-27)25-13-19-8-7-11-23(20-12-22(35)15-30-14-20)26(19)28(36)34(25)21-9-5-4-6-10-21/h4-11,13-17H,12H2,1-3H3;5-16H,1-2,4H3,(H,31,34,35);5-16H,1-3H3,(H,33,34,35);4-17,35H,1-2H3,(H,31,32,33)/t17-;2*16-;17-/m1000/s1
InChIKeyAXWYVRXKXWBHSR-QNBYXMRVSA-N
XLogP22.64
TPSA369.21 Ų
H-Bond Donors4
H-Bond Acceptors29
Rotatable Bonds22
Heavy Atoms150
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002005.12
LogP ≤ 522.64
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Preparation of 3-{4-[4-(3-{[1-({[7-(8-ethyl-7-fluoro-3-hydroxynaphthalen-1-yl)-8-fluoro-4-[(3R)-3-hydroxy-3-methylpiperidin-1-yl]pyrido[4,3-d]pyrimidin-2-yl]oxy}methyl) cyclopropyl]methyl)-3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-2,6-difluorophenyl}piperidine-2,6-dione
CID 171658059
3-[(1S)-1-[[5-(3-fluoro-4-hydroxyphenyl)-2-methylpyrimidin-4-yl]amino]ethyl]-8-(2-methyl-4-pyridinyl)-2-phenylisoquinolin-1-one
CID 71273681
3-[(1S)-1-[[5-(3-fluoro-5-hydroxyphenyl)-2-methylpyrimidin-4-yl]amino]ethyl]-8-(2-methyl-4-pyridinyl)-2-phenylisoquinolin-1-one
CID 71273682
3-[(1S)-1-[[2-amino-5-(3-fluoro-5-hydroxyphenyl)pyrimidin-4-yl]amino]ethyl]-8-(2-methyl-4-pyridinyl)-2-phenylisoquinolin-1-one
CID 71273839
3-[(1S)-1-[[2-amino-5-(4-fluoro-3-hydroxyphenyl)pyrimidin-4-yl]amino]ethyl]-8-(2-methyl-4-pyridinyl)-2-phenylisoquinolin-1-one
CID 71273851
3-[(1S)-1-[[2-amino-5-(3-fluoro-4-hydroxyphenyl)pyrimidin-4-yl]amino]ethyl]-8-(2-methyl-4-pyridinyl)-2-phenylisoquinolin-1-one
CID 71274113
3-[(1S)-1-[(2,5-diaminopyrimidin-4-yl)amino]ethyl]-8-[5-(difluoromethoxy)-3-pyridinyl]-2-phenylisoquinolin-1-one
CID 71291817
3-[(1S)-1-[(2-amino-5-isocyanopyrimidin-4-yl)amino]ethyl]-2-phenyl-8-[5-(trifluoromethoxy)-3-pyridinyl]isoquinolin-1-one
CID 123247790
3-[(1S)-1-[(2-amino-5-isocyanopyrimidin-4-yl)amino]ethyl]-2-(3-fluorophenyl)-8-(5-methoxy-3-pyridinyl)isoquinolin-1-one
CID 123736102
3-[(1S)-1-[(2-amino-5-isocyanopyrimidin-4-yl)amino]ethyl]-8-[5-(difluoromethoxy)-3-pyridinyl]-2-phenylisoquinolin-1-one
CID 123844146
2-fluoro-N-[1-[2-[4-fluoro-5-[[5-[5-(hydroxymethyl)-2-pyridinyl]-2-phenyl-3-pyridinyl]carbamoyl]-2-(trifluoromethyl)phenyl]pyrimidin-5-yl]-2-phenyl-5-pyridin-2-yloxypyridin-1-ium-3-yl]-5-pyrimidin-2-yl-4-(trifluoromethyl)benzamide
CID 123927950
3-[(1S)-1-[[2-amino-5-(4-fluoro-3-hydroxyphenyl)pyrimidin-4-yl]amino]ethyl]-8-(5-methoxy-3-pyridinyl)-2-phenylisoquinolin-1-one
CID 129128720

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one?
The IUPAC name of 2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one (CID 157265028) is 2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one.
What is the SMILES notation for 2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one?
The canonical SMILES for 2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one is COc1ncc(-c2cccc3cc([C@H](C)Cc4nc(C)ncc4C(F)(F)F)n(-c4ccccc4)c(=O)c23)cn1.[C-]#[N+]c1cnc(C)nc1N[C@@H](C)c1cc2cccc(-c3cnc(C)nc3)c2c(=O)n1-c1cccc(F)c1.[C-]#[N+]c1cnc(C)nc1N[C@@H](C)c1cc2cccc(-c3cnc(OC)nc3)c2c(=O)n1-c1cccc(F)c1.[C-]#[N+]c1cnc(C)nc1N[C@@H](C)c1cc2cccc(-c3cncc(O)c3)c2c(=O)n1-c1ccccc1.
What is the InChIKey of 2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one?
The InChIKey is AXWYVRXKXWBHSR-QNBYXMRVSA-N. The full InChI is InChI=1S/C29H24F3N5O2.C28H22FN7O2.C28H22FN7O.C28H22N6O2/c1-17(12-24-23(29(30,31)32)16-33-18(2)36-24)25-13-19-8-7-11-22(20-14-34-28(39-3)35-15-20)26(19)27(38)37(25)21-9-5-4-6-10-21;1-16(34-26-23(30-3)15-31-17(2)35-26)24-11-18-7-5-10-22(19-13-32-28(38-4)33-14-19)25(18)27(37)36(24)21-9-6-8-20(29)12-21;1-16(34-27-24(30-4)15-33-18(3)35-27)25-11-19-7-5-10-23(20-13-31-17(2)32-14-20)26(19)28(37)36(25)22-9-6-8-21(29)12-22;1-17(32-27-24(29-3)16-31-18(2)33-27)25-13-19-8-7-11-23(20-12-22(35)15-30-14-20)26(19)28(36)34(25)21-9-5-4-6-10-21/h4-11,13-17H,12H2,1-3H3;5-16H,1-2,4H3,(H,31,34,35);5-16H,1-3H3,(H,33,34,35);4-17,35H,1-2H3,(H,31,32,33)/t17-;2*16-;17-/m1000/s1.
What are the key properties of 2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one?
2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one has a molecular weight of 2005.12 g/mol, XLogP of 22.64, 22 rotatable bonds, 4 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methoxypyrimidin-5-yl)isoquinolin-1-one;2-(3-fluorophenyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-8-(2-methylpyrimidin-5-yl)isoquinolin-1-one;8-(5-hydroxy-3-pyridinyl)-3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-(2-methoxypyrimidin-5-yl)-3-[(2R)-1-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]propan-2-yl]-2-phenylisoquinolin-1-one is sourced from PubChem (CID 157265028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).