C267H320Br10N72O25Si — CID 157270040
2-[[2-amino-5-[(2-cyclopropyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]butan-1-ol;4-(4-amino-2-methylpyrimidin-5-yl)oxy-6-methoxypyridine-3-carbonitrile;4-(4-amino-2-methylpyrimidin-5-yl)oxy-6-methoxypyridine-3-carboximidamide;N-benzyl-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-bromo-5-(2-methylpropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-cyclohexyl-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-[(1R)-1-cyclopropylethyl]-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-cyclopropyl-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N,2-dimethylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-ethyl-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methyl-N-(2-methylpropyl)pyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methyl-N-propan-2-ylpyrimidin-4-amine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]ethanol;5-[(5-ethynyl-2-methoxy-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(2-methoxy-5-methyl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-methoxy-5-[(E)-2-phenylethenyl]-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-methoxy-5-(2-trimethylsilylethynyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine (PubChem CID 157270040) has the molecular formula C267H320Br10N72O25Si and a molecular weight of 5765.10 g/mol. Its IUPAC name is 2-[[2-amino-5-[(2-cyclopropyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]butan-1-ol;4-(4-amino-2-methylpyrimidin-5-yl)oxy-6-methoxypyridine-3-carbonitrile;4-(4-amino-2-methylpyrimidin-5-yl)oxy-6-methoxypyridine-3-carboximidamide;N-benzyl-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-bromo-5-(2-methylpropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-cyclohexyl-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-[(1R)-1-cyclopropylethyl]-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-cyclopropyl-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N,2-dimethylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-ethyl-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methyl-N-(2-methylpropyl)pyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methyl-N-propan-2-ylpyrimidin-4-amine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]ethanol;5-[(5-ethynyl-2-methoxy-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(2-methoxy-5-methyl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-methoxy-5-[(E)-2-phenylethenyl]-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-methoxy-5-(2-trimethylsilylethynyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine.
| Compound Name | 2-[[2-amino-5-[(2-cyclopropyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]butan-1-ol;4-(4-amino-2-methylpyrimidin-5-yl)oxy-6-methoxypyridine-3-carbonitrile;4-(4-amino-2-methylpyrimidin-5-yl)oxy-6-methoxypyridine-3-carboximidamide;N-benzyl-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-bromo-5-(2-methylpropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-cyclohexyl-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-[(1R)-1-cyclopropylethyl]-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-cyclopropyl-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N,2-dimethylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-ethyl-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methyl-N-(2-methylpropyl)pyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methyl-N-propan-2-ylpyrimidin-4-amine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]ethanol;5-[(5-ethynyl-2-methoxy-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(2-methoxy-5-methyl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-methoxy-5-[(E)-2-phenylethenyl]-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-methoxy-5-(2-trimethylsilylethynyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine |
|---|---|
| PubChem CID | 157270040 |
| Molecular Formula | C267H320Br10N72O25Si |
| Molecular Weight | 5765.10 g/mol |
| Exact Mass | 5751.76 |
| IUPAC Name | 2-[[2-amino-5-[(2-cyclopropyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]butan-1-ol;4-(4-amino-2-methylpyrimidin-5-yl)oxy-6-methoxypyridine-3-carbonitrile;4-(4-amino-2-methylpyrimidin-5-yl)oxy-6-methoxypyridine-3-carboximidamide;N-benzyl-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-bromo-5-(2-methylpropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-cyclohexyl-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-[(1R)-1-cyclopropylethyl]-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-cyclopropyl-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N,2-dimethylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-N-ethyl-2-methylpyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methyl-N-(2-methylpropyl)pyrimidin-4-amine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methyl-N-propan-2-ylpyrimidin-4-amine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]ethanol;5-[(5-ethynyl-2-methoxy-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(2-methoxy-5-methyl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-methoxy-5-[(E)-2-phenylethenyl]-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-methoxy-5-(2-trimethylsilylethynyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine |
| SMILES | C#Cc1cnc(OC)cc1Oc1cnc(C)nc1N.CCC(CO)Nc1nc(N)ncc1Oc1cc(C2CC2)ncc1C(C)C.CCNc1nc(C)ncc1Oc1cc(Br)ncc1C(C)C.CNc1nc(C)ncc1Oc1cc(Br)ncc1C(C)C.COc1cc(Oc2cnc(C)nc2N)c(/C=C/c2ccccc2)cn1.COc1cc(Oc2cnc(C)nc2N)c(C#C[Si](C)(C)C)cn1.COc1cc(Oc2cnc(C)nc2N)c(C#N)cn1.COc1cc(Oc2cnc(C)nc2N)c(C)cn1.Cc1ncc(Oc2cc(Br)ncc2C(C)C)c(NC(C)C)n1.Cc1ncc(Oc2cc(Br)ncc2C(C)C)c(NC2CC2)n1.Cc1ncc(Oc2cc(Br)ncc2C(C)C)c(NC2CCCCC2)n1.Cc1ncc(Oc2cc(Br)ncc2C(C)C)c(NCC(C)C)n1.Cc1ncc(Oc2cc(Br)ncc2C(C)C)c(NCCO)n1.Cc1ncc(Oc2cc(Br)ncc2C(C)C)c(NCc2ccccc2)n1.Cc1ncc(Oc2cc(Br)ncc2C(C)C)c(N[C@H](C)C2CC2)n1.Cc1ncc(Oc2cc(Br)ncc2CC(C)C)c(N)n1.[H]/N=C(\N)c1cnc(OC)cc1Oc1cnc(C)nc1N |
| InChI | InChI=1S/C20H21BrN4O.C19H25BrN4O.C19H27N5O2.C19H18N4O2.C18H23BrN4O.C17H23BrN4O.C16H19BrN4O.C16H21BrN4O.C16H20N4O2Si.C15H19BrN4O2.C15H19BrN4O.2C14H17BrN4O.C13H12N4O2.C12H14N6O2.C12H11N5O2.C12H14N4O2/c1-13(2)16-11-23-19(21)9-17(16)26-18-12-22-14(3)25-20(18)24-10-15-7-5-4-6-8-15;1-12(2)15-10-22-18(20)9-16(15)25-17-11-21-13(3)23-19(17)24-14-7-5-4-6-8-14;1-4-13(10-25)23-18-17(9-22-19(20)24-18)26-16-7-15(12-5-6-12)21-8-14(16)11(2)3;1-13-21-12-17(19(20)23-13)25-16-10-18(24-2)22-11-15(16)9-8-14-6-4-3-5-7-14;1-10(2)14-8-21-17(19)7-15(14)24-16-9-20-12(4)23-18(16)22-11(3)13-5-6-13;1-10(2)7-21-17-15(9-19-12(5)22-17)23-14-6-16(18)20-8-13(14)11(3)4;1-9(2)12-7-19-15(17)6-13(12)22-14-8-18-10(3)20-16(14)21-11-4-5-11;1-9(2)12-7-19-15(17)6-13(12)22-14-8-18-11(5)21-16(14)20-10(3)4;1-11-18-10-14(16(17)20-11)22-13-8-15(21-2)19-9-12(13)6-7-23(3,4)5;1-9(2)11-7-19-14(16)6-12(11)22-13-8-18-10(3)20-15(13)17-4-5-21;1-5-17-15-13(8-18-10(4)20-15)21-12-6-14(16)19-7-11(12)9(2)3;1-8(2)10-6-18-13(15)5-11(10)20-12-7-17-9(3)19-14(12)16-4;1-8(2)4-10-6-18-13(15)5-11(10)20-12-7-17-9(3)19-14(12)16;1-4-9-6-16-12(18-3)5-10(9)19-11-7-15-8(2)17-13(11)14;1-6-16-5-9(12(15)18-6)20-8-3-10(19-2)17-4-7(8)11(13)14;1-7-15-6-10(12(14)17-7)19-9-3-11(18-2)16-5-8(9)4-13;1-7-5-15-11(17-3)4-9(7)18-10-6-14-8(2)16-12(10)13/h4-9,11-13H,10H2,1-3H3,(H,22,24,25);9-12,14H,4-8H2,1-3H3,(H,21,23,24);7-9,11-13,25H,4-6,10H2,1-3H3,(H3,20,22,23,24);3-12H,1-2H3,(H2,20,21,23);7-11,13H,5-6H2,1-4H3,(H,20,22,23);6,8-11H,7H2,1-5H3,(H,19,21,22);6-9,11H,4-5H2,1-3H3,(H,18,20,21);6-10H,1-5H3,(H,18,20,21);8-10H,1-5H3,(H2,17,18,20);6-9,21H,4-5H2,1-3H3,(H,17,18,20);6-9H,5H2,1-4H3,(H,17,18,20);5-8H,1-4H3,(H,16,17,19);5-8H,4H2,1-3H3,(H2,16,17,19);1,5-7H,2-3H3,(H2,14,15,17);3-5H,1-2H3,(H3,13,14)(H2,15,16,18);3,5-6H,1-2H3,(H2,14,15,17);4-6H,1-3H3,(H2,13,14,16)/b;;;9-8+;;;;;;;;;;;;;/t;;;;11-;;;;;;;;;;;;/m....1............/s1 |
| InChIKey | AYKVBRNSBNMMKA-RBLJMGMYSA-N |
| XLogP | 60.80 |
| TPSA | 1312.26 Ų |
| H-Bond Donors | 22 |
| H-Bond Acceptors | 96 |
| Rotatable Bonds | 81 |
| Heavy Atoms | 375 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 5765.10 |
| LogP ≤ 5 | 60.80 |
| H-Bond Donors ≤ 5 | 22 |
| H-Bond Acceptors ≤ 10 | 96 |