2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one

C152H168N42O12 — CID 165070885

About 2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one

2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one (PubChem CID 165070885) has the molecular formula C152H168N42O12 and a molecular weight of 2775.30 g/mol. Its IUPAC name is 2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one.

Molecular Properties

• Compound Name: 2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one
• PubChem CID: 165070885
• Molecular Formula: C152H168N42O12
• Molecular Weight: 2775.30 g/mol
• Exact Mass: 2773.38
• IUPAC Name: 2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one
• SMILES: CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4(C)C)nc2n1-c1nc(C2(C)CC2)co1.CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4)nc2n1-c1nc(C2(C)CC2)co1.CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CNCC43CC3)nc2n1-c1nc(C2(C)CC2)co1.CC1(C)CNCc2cc(Nc3ncc4c(=O)n(C5CC5)n(-c5nc(C6(C)CC6)co5)c4n3)ccc21.CC1(c2coc(-n3c4nc(Nc5ccc6c(c5)CNCC6)ncc4c(=O)n3C3CC3)n2)CC1.CC1(c2coc(-n3c4nc(Nc5ccc6c(c5)CNCC65CC5)ncc4c(=O)n3C3CC3)n2)CC1
• InChI: InChI=1S/C26H27N7O2.2C26H29N7O2.C26H31N7O2.C24H25N7O2.C24H27N7O2/c1-25(6-7-25)20-13-35-24(30-20)33-21-18(22(34)32(33)17-3-4-17)12-28-23(31-21)29-16-2-5-19-15(10-16)11-27-14-26(19)8-9-26;1-25(2)14-27-11-15-10-16(4-7-19(15)25)29-23-28-12-18-21(31-23)33(32(22(18)34)17-5-6-17)24-30-20(13-35-24)26(3)8-9-26;1-15(2)32-22(34)18-12-28-23(29-17-4-5-19-16(10-17)11-27-14-26(19)8-9-26)31-21(18)33(32)24-30-20(13-35-24)25(3)6-7-25;1-15(2)32-22(34)18-12-28-23(29-17-6-7-19-16(10-17)11-27-14-25(19,3)4)31-21(18)33(32)24-30-20(13-35-24)26(5)8-9-26;1-24(7-8-24)19-13-33-23(28-19)31-20-18(21(32)30(31)17-4-5-17)12-26-22(29-20)27-16-3-2-14-6-9-25-11-15(14)10-16;1-14(2)30-21(32)18-12-26-22(27-17-5-4-15-6-9-25-11-16(15)10-17)29-20(18)31(30)23-28-19(13-33-23)24(3)7-8-24/h2,5,10,12-13,17,27H,3-4,6-9,11,14H2,1H3,(H,28,29,31);4,7,10,12-13,17,27H,5-6,8-9,11,14H2,1-3H3,(H,28,29,31);4-5,10,12-13,15,27H,6-9,11,14H2,1-3H3,(H,28,29,31);6-7,10,12-13,15,27H,8-9,11,14H2,1-5H3,(H,28,29,31);2-3,10,12-13,17,25H,4-9,11H2,1H3,(H,26,27,29);4-5,10,12-14,25H,6-9,11H2,1-3H3,(H,26,27,29)
• InChIKey: SSQVRRIVXUNOEQ-UHFFFAOYSA-N
• XLogP: 23.26
• TPSA: 616.80 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 54
• Rotatable Bonds: 30
• Heavy Atoms: 206
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2775.30
LogP ≤ 5	23.26
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	54

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one?

The IUPAC name of 2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one (CID 165070885) is 2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one.

What is the SMILES notation for 2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one?

The canonical SMILES for 2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one is CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4(C)C)nc2n1-c1nc(C2(C)CC2)co1.CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4)nc2n1-c1nc(C2(C)CC2)co1.CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CNCC43CC3)nc2n1-c1nc(C2(C)CC2)co1.CC1(C)CNCc2cc(Nc3ncc4c(=O)n(C5CC5)n(-c5nc(C6(C)CC6)co5)c4n3)ccc21.CC1(c2coc(-n3c4nc(Nc5ccc6c(c5)CNCC6)ncc4c(=O)n3C3CC3)n2)CC1.CC1(c2coc(-n3c4nc(Nc5ccc6c(c5)CNCC65CC5)ncc4c(=O)n3C3CC3)n2)CC1.

What is the InChIKey of 2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one?

The InChIKey is SSQVRRIVXUNOEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N7O2.2C26H29N7O2.C26H31N7O2.C24H25N7O2.C24H27N7O2/c1-25(6-7-25)20-13-35-24(30-20)33-21-18(22(34)32(33)17-3-4-17)12-28-23(31-21)29-16-2-5-19-15(10-16)11-27-14-26(19)8-9-26;1-25(2)14-27-11-15-10-16(4-7-19(15)25)29-23-28-12-18-21(31-23)33(32(22(18)34)17-5-6-17)24-30-20(13-35-24)26(3)8-9-26;1-15(2)32-22(34)18-12-28-23(29-17-4-5-19-16(10-17)11-27-14-26(19)8-9-26)31-21(18)33(32)24-30-20(13-35-24)25(3)6-7-25;1-15(2)32-22(34)18-12-28-23(29-17-6-7-19-16(10-17)11-27-14-25(19,3)4)31-21(18)33(32)24-30-20(13-35-24)26(5)8-9-26;1-24(7-8-24)19-13-33-23(28-19)31-20-18(21(32)30(31)17-4-5-17)12-26-22(29-20)27-16-3-2-14-6-9-25-11-15(14)10-16;1-14(2)30-21(32)18-12-26-22(27-17-5-4-15-6-9-25-11-16(15)10-17)29-20(18)31(30)23-28-19(13-33-23)24(3)7-8-24/h2,5,10,12-13,17,27H,3-4,6-9,11,14H2,1H3,(H,28,29,31);4,7,10,12-13,17,27H,5-6,8-9,11,14H2,1-3H3,(H,28,29,31);4-5,10,12-13,15,27H,6-9,11,14H2,1-3H3,(H,28,29,31);6-7,10,12-13,15,27H,8-9,11,14H2,1-5H3,(H,28,29,31);2-3,10,12-13,17,25H,4-9,11H2,1H3,(H,26,27,29);4-5,10,12-14,25H,6-9,11H2,1-3H3,(H,26,27,29).

What are the key properties of 2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one?

2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one has a molecular weight of 2775.30 g/mol, XLogP of 23.26, 30 rotatable bonds, 12 hydrogen bond donors, and 54 hydrogen bond acceptors.

Where does this data come from?

All data for 2-cyclopropyl-6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;2-cyclopropyl-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;6-[(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)amino]-1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one;1-[4-(1-methylcyclopropyl)-1,3-oxazol-2-yl]-2-propan-2-yl-6-(1,2,3,4-tetrahydroisoquinolin-7-ylamino)pyrazolo[3,4-d]pyrimidin-3-one is sourced from PubChem (CID 165070885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).