4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine
C172H155Cl2N45O3 — CID 159627176
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine
SMILESCC1(C)CCc2c(-c3ccccc3)nc3n[nH]c(N)c3c2C1.Cc1cc(-c2ccccc2)nc2n[nH]c(N)c12.Cc1cc(-c2ccccc2Cl)nc2n[nH]c(N)c12.Cc1ccc(NC(=O)c2cccc(Cl)c2)cc1-c1nc2n[nH]c(N)c2c2c1CCCC2.Cc1ccccc1-c1cc(-c2ccccc2)c2c(N)[nH]nc2n1.Cc1ccccc1-c1cc(C)c2c(N)[nH]nc2n1.N#Cc1ccc(-c2cc(-c3ccccc3)c3c(N)[nH]nc3n2)cc1.Nc1[nH]nc2nc(-c3ccc4c(c3)OCCO4)c3c(c12)CCCC3.Nc1[nH]nc2nc(-c3cccc4[nH]ncc34)c3c(c12)CCCC3.Nc1[nH]nc2nc(-c3cccnc3)cc(-c3ccccc3)c12
InChIInChI=1S/C24H22ClN5O.C19H13N5.C19H16N4.C18H18N4O2.C18H20N4.C17H16N6.C17H13N5.C14H14N4.C13H11ClN4.C13H12N4/c1-13-9-10-16(27-24(31)14-5-4-6-15(25)11-14)12-19(13)21-18-8-3-2-7-17(18)20-22(26)29-30-23(20)28-21;20-11-12-6-8-14(9-7-12)16-10-15(13-4-2-1-3-5-13)17-18(21)23-24-19(17)22-16;1-12-7-5-6-10-14(12)16-11-15(13-8-3-2-4-9-13)17-18(20)22-23-19(17)21-16;19-17-15-11-3-1-2-4-12(11)16(20-18(15)22-21-17)10-5-6-13-14(9-10)24-8-7-23-13;1-18(2)9-8-12-13(10-18)14-16(19)21-22-17(14)20-15(12)11-6-4-3-5-7-11;18-16-14-9-4-1-2-5-10(9)15(20-17(14)23-22-16)11-6-3-7-13-12(11)8-19-21-13;18-16-15-13(11-5-2-1-3-6-11)9-14(20-17(15)22-21-16)12-7-4-8-19-10-12;1-8-5-3-4-6-10(8)11-7-9(2)12-13(15)17-18-14(12)16-11;1-7-6-10(8-4-2-3-5-9(8)14)16-13-11(7)12(15)17-18-13;1-8-7-10(9-5-3-2-4-6-9)15-13-11(8)12(14)16-17-13/h4-6,9-12H,2-3,7-8H2,1H3,(H,27,31)(H3,26,28,29,30);1-10H,(H3,21,22,23,24);2-11H,1H3,(H3,20,21,22,23);5-6,9H,1-4,7-8H2,(H3,19,20,21,22);3-7H,8-10H2,1-2H3,(H3,19,20,21,22);3,6-8H,1-2,4-5H2,(H,19,21)(H3,18,20,22,23);1-10H,(H3,18,20,21,22);3-7H,1-2H3,(H3,15,16,17,18);2-6H,1H3,(H3,15,16,17,18);2-7H,1H3,(H3,14,15,16,17)
InChIKeyMOQMXTBLBNGKQD-UHFFFAOYSA-N
MW2971.35 g/mol
LogP34.55
Rot. Bonds15
About 4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine
4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine (PubChem CID 159627176) has the molecular formula C172H155Cl2N45O3 and a molecular weight of 2971.35 g/mol. Its IUPAC name is 4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine.
Molecular Properties
| Compound Name | 4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine |
|---|---|
| PubChem CID | 159627176 |
| Molecular Formula | C172H155Cl2N45O3 |
| Molecular Weight | 2971.35 g/mol |
| Exact Mass | 2968.27 |
| IUPAC Name | 4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine |
| SMILES | CC1(C)CCc2c(-c3ccccc3)nc3n[nH]c(N)c3c2C1.Cc1cc(-c2ccccc2)nc2n[nH]c(N)c12.Cc1cc(-c2ccccc2Cl)nc2n[nH]c(N)c12.Cc1ccc(NC(=O)c2cccc(Cl)c2)cc1-c1nc2n[nH]c(N)c2c2c1CCCC2.Cc1ccccc1-c1cc(-c2ccccc2)c2c(N)[nH]nc2n1.Cc1ccccc1-c1cc(C)c2c(N)[nH]nc2n1.N#Cc1ccc(-c2cc(-c3ccccc3)c3c(N)[nH]nc3n2)cc1.Nc1[nH]nc2nc(-c3ccc4c(c3)OCCO4)c3c(c12)CCCC3.Nc1[nH]nc2nc(-c3cccc4[nH]ncc34)c3c(c12)CCCC3.Nc1[nH]nc2nc(-c3cccnc3)cc(-c3ccccc3)c12 |
| InChI | InChI=1S/C24H22ClN5O.C19H13N5.C19H16N4.C18H18N4O2.C18H20N4.C17H16N6.C17H13N5.C14H14N4.C13H11ClN4.C13H12N4/c1-13-9-10-16(27-24(31)14-5-4-6-15(25)11-14)12-19(13)21-18-8-3-2-7-17(18)20-22(26)29-30-23(20)28-21;20-11-12-6-8-14(9-7-12)16-10-15(13-4-2-1-3-5-13)17-18(21)23-24-19(17)22-16;1-12-7-5-6-10-14(12)16-11-15(13-8-3-2-4-9-13)17-18(20)22-23-19(17)21-16;19-17-15-11-3-1-2-4-12(11)16(20-18(15)22-21-17)10-5-6-13-14(9-10)24-8-7-23-13;1-18(2)9-8-12-13(10-18)14-16(19)21-22-17(14)20-15(12)11-6-4-3-5-7-11;18-16-14-9-4-1-2-5-10(9)15(20-17(14)23-22-16)11-6-3-7-13-12(11)8-19-21-13;18-16-15-13(11-5-2-1-3-6-11)9-14(20-17(15)22-21-16)12-7-4-8-19-10-12;1-8-5-3-4-6-10(8)11-7-9(2)12-13(15)17-18-14(12)16-11;1-7-6-10(8-4-2-3-5-9(8)14)16-13-11(7)12(15)17-18-13;1-8-7-10(9-5-3-2-4-6-9)15-13-11(8)12(14)16-17-13/h4-6,9-12H,2-3,7-8H2,1H3,(H,27,31)(H3,26,28,29,30);1-10H,(H3,21,22,23,24);2-11H,1H3,(H3,20,21,22,23);5-6,9H,1-4,7-8H2,(H3,19,20,21,22);3-7H,8-10H2,1-2H3,(H3,19,20,21,22);3,6-8H,1-2,4-5H2,(H,19,21)(H3,18,20,22,23);1-10H,(H3,18,20,21,22);3-7H,1-2H3,(H3,15,16,17,18);2-6H,1H3,(H3,15,16,17,18);2-7H,1H3,(H3,14,15,16,17) |
| InChIKey | MOQMXTBLBNGKQD-UHFFFAOYSA-N |
| XLogP | 34.55 |
| TPSA | 788.82 Ų |
| H-Bond Donors | 22 |
| H-Bond Acceptors | 36 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 222 |
| Complexity | — |
Lipinski Rule of Five
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2971.35 |
| LogP ≤ 5 | 34.55 |
| H-Bond Donors ≤ 5 | 22 |
| H-Bond Acceptors ≤ 10 | 36 |
Frequently Asked Questions
What is the IUPAC name of 4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine?
The IUPAC name of 4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine (CID 159627176) is 4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine.
What is the SMILES notation for 4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine?
The canonical SMILES for 4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine is CC1(C)CCc2c(-c3ccccc3)nc3n[nH]c(N)c3c2C1.Cc1cc(-c2ccccc2)nc2n[nH]c(N)c12.Cc1cc(-c2ccccc2Cl)nc2n[nH]c(N)c12.Cc1ccc(NC(=O)c2cccc(Cl)c2)cc1-c1nc2n[nH]c(N)c2c2c1CCCC2.Cc1ccccc1-c1cc(-c2ccccc2)c2c(N)[nH]nc2n1.Cc1ccccc1-c1cc(C)c2c(N)[nH]nc2n1.N#Cc1ccc(-c2cc(-c3ccccc3)c3c(N)[nH]nc3n2)cc1.Nc1[nH]nc2nc(-c3ccc4c(c3)OCCO4)c3c(c12)CCCC3.Nc1[nH]nc2nc(-c3cccc4[nH]ncc34)c3c(c12)CCCC3.Nc1[nH]nc2nc(-c3cccnc3)cc(-c3ccccc3)c12.
What is the InChIKey of 4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine?
The InChIKey is MOQMXTBLBNGKQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22ClN5O.C19H13N5.C19H16N4.C18H18N4O2.C18H20N4.C17H16N6.C17H13N5.C14H14N4.C13H11ClN4.C13H12N4/c1-13-9-10-16(27-24(31)14-5-4-6-15(25)11-14)12-19(13)21-18-8-3-2-7-17(18)20-22(26)29-30-23(20)28-21;20-11-12-6-8-14(9-7-12)16-10-15(13-4-2-1-3-5-13)17-18(21)23-24-19(17)22-16;1-12-7-5-6-10-14(12)16-11-15(13-8-3-2-4-9-13)17-18(20)22-23-19(17)21-16;19-17-15-11-3-1-2-4-12(11)16(20-18(15)22-21-17)10-5-6-13-14(9-10)24-8-7-23-13;1-18(2)9-8-12-13(10-18)14-16(19)21-22-17(14)20-15(12)11-6-4-3-5-7-11;18-16-14-9-4-1-2-5-10(9)15(20-17(14)23-22-16)11-6-3-7-13-12(11)8-19-21-13;18-16-15-13(11-5-2-1-3-6-11)9-14(20-17(15)22-21-16)12-7-4-8-19-10-12;1-8-5-3-4-6-10(8)11-7-9(2)12-13(15)17-18-14(12)16-11;1-7-6-10(8-4-2-3-5-9(8)14)16-13-11(7)12(15)17-18-13;1-8-7-10(9-5-3-2-4-6-9)15-13-11(8)12(14)16-17-13/h4-6,9-12H,2-3,7-8H2,1H3,(H,27,31)(H3,26,28,29,30);1-10H,(H3,21,22,23,24);2-11H,1H3,(H3,20,21,22,23);5-6,9H,1-4,7-8H2,(H3,19,20,21,22);3-7H,8-10H2,1-2H3,(H3,19,20,21,22);3,6-8H,1-2,4-5H2,(H,19,21)(H3,18,20,22,23);1-10H,(H3,18,20,21,22);3-7H,1-2H3,(H3,15,16,17,18);2-6H,1H3,(H3,15,16,17,18);2-7H,1H3,(H3,14,15,16,17).
What are the key properties of 4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine?
4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine has a molecular weight of 2971.35 g/mol, XLogP of 34.55, 15 rotatable bonds, 22 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)benzonitrile;N-[3-(1-amino-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-5-yl)-4-methylphenyl]-3-chlorobenzamide;6-(2-chlorophenyl)-4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine;5-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;8,8-dimethyl-5-phenyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;5-(1H-indazol-4-yl)-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine;4-methyl-6-(2-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine;6-(2-methylphenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-methyl-6-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine;4-phenyl-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridin-3-amine is sourced from PubChem (CID 159627176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 159627176 — identifiers, structure, computed properties (public domain)
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