[2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine

C226H258ClF4N59O21S — CID 159962531

IUPAC[2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine
SMILESCC(C)(C)Nc1nc(-c2ccco2)n2ncc(C(O)c3cccc(F)c3)c2n1.CC(C)(C)Nc1nc(-c2ccco2)n2ncc(Cc3cccc(F)c3)c2n1.CCC(Cl)c1cccc(Cc2cnn3c(-c4ccc(C)o4)nc(NC(C)(C)C)nc23)n1.CCC(O)c1cccc(Cc2cnn3c(-c4ccc(C)o4)nc(NC(C)(C)C)nc23)n1.CCCc1cccc(Cc2cnn3c(-c4ccc(C)o4)nc(NC(C)(C)C)nc23)n1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Nc4cccc(CO[C@H]5CCOC5)c4F)cnn23)o1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Nc4cccc(CO[C@H]5CCOC5)n4)cnn23)o1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Nc4ccccc4F)cnn23)o1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Oc4cccc(CO[C@H]5CCOC5)n4)cnn23)o1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Sc4cccc(CO[C@H]5CCOC5)n4)cnn23)o1
InChIInChI=1S/C25H29FN6O3.C24H29N7O3.C24H28N6O4.C24H28N6O3S.C23H27ClN6O.C23H28N6O2.C23H28N6O.C20H21FN6O.C20H20FN5O2.C20H20FN5O/c1-15-8-9-20(35-15)23-30-24(31-25(2,3)4)29-22-19(12-27-32(22)23)28-18-7-5-6-16(21(18)26)13-34-17-10-11-33-14-17;1-15-8-9-19(34-15)22-29-23(30-24(2,3)4)28-21-18(12-25-31(21)22)27-20-7-5-6-16(26-20)13-33-17-10-11-32-14-17;2*1-15-8-9-18(33-15)21-27-23(29-24(2,3)4)28-22-19(12-25-30(21)22)34-20-7-5-6-16(26-20)13-32-17-10-11-31-14-17;1-6-17(24)18-9-7-8-16(26-18)12-15-13-25-30-20(15)27-22(29-23(3,4)5)28-21(30)19-11-10-14(2)31-19;1-6-18(30)17-9-7-8-16(25-17)12-15-13-24-29-20(15)26-22(28-23(3,4)5)27-21(29)19-11-10-14(2)31-19;1-6-8-17-9-7-10-18(25-17)13-16-14-24-29-20(16)26-22(28-23(3,4)5)27-21(29)19-12-11-15(2)30-19;1-12-9-10-16(28-12)18-25-19(26-20(2,3)4)24-17-15(11-22-27(17)18)23-14-8-6-5-7-13(14)21;1-20(2,3)25-19-23-17-14(16(27)12-6-4-7-13(21)10-12)11-22-26(17)18(24-19)15-8-5-9-28-15;1-20(2,3)25-19-23-17-14(10-13-6-4-7-15(21)11-13)12-22-26(17)18(24-19)16-8-5-9-27-16/h5-9,12,17,28H,10-11,13-14H2,1-4H3,(H,29,31);5-9,12,17H,10-11,13-14H2,1-4H3,(H,26,27)(H,28,30);2*5-9,12,17H,10-11,13-14H2,1-4H3,(H,28,29);7-11,13,17H,6,12H2,1-5H3,(H,27,29);7-11,13,18,30H,6,12H2,1-5H3,(H,26,28);7,9-12,14H,6,8,13H2,1-5H3,(H,26,28);5-11,23H,1-4H3,(H,24,26);4-11,16,27H,1-3H3,(H,23,25);4-9,11-12H,10H2,1-3H3,(H,23,25)/t4*17-;;;;;;/m0000....../s1
InChIKeyODNAKBOLVOWAKJ-YHUPPDITSA-N
MW4280.45 g/mol
LogP46.27
Rot. Bonds58

About [2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine

[2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine (PubChem CID 159962531) has the molecular formula C226H258ClF4N59O21S and a molecular weight of 4280.45 g/mol. Its IUPAC name is [2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine.

Molecular Properties

Compound Name[2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine
PubChem CID159962531
Molecular FormulaC226H258ClF4N59O21S
Molecular Weight4280.45 g/mol
Exact Mass4277.03
IUPAC Name[2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine
SMILESCC(C)(C)Nc1nc(-c2ccco2)n2ncc(C(O)c3cccc(F)c3)c2n1.CC(C)(C)Nc1nc(-c2ccco2)n2ncc(Cc3cccc(F)c3)c2n1.CCC(Cl)c1cccc(Cc2cnn3c(-c4ccc(C)o4)nc(NC(C)(C)C)nc23)n1.CCC(O)c1cccc(Cc2cnn3c(-c4ccc(C)o4)nc(NC(C)(C)C)nc23)n1.CCCc1cccc(Cc2cnn3c(-c4ccc(C)o4)nc(NC(C)(C)C)nc23)n1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Nc4cccc(CO[C@H]5CCOC5)c4F)cnn23)o1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Nc4cccc(CO[C@H]5CCOC5)n4)cnn23)o1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Nc4ccccc4F)cnn23)o1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Oc4cccc(CO[C@H]5CCOC5)n4)cnn23)o1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Sc4cccc(CO[C@H]5CCOC5)n4)cnn23)o1
InChIInChI=1S/C25H29FN6O3.C24H29N7O3.C24H28N6O4.C24H28N6O3S.C23H27ClN6O.C23H28N6O2.C23H28N6O.C20H21FN6O.C20H20FN5O2.C20H20FN5O/c1-15-8-9-20(35-15)23-30-24(31-25(2,3)4)29-22-19(12-27-32(22)23)28-18-7-5-6-16(21(18)26)13-34-17-10-11-33-14-17;1-15-8-9-19(34-15)22-29-23(30-24(2,3)4)28-21-18(12-25-31(21)22)27-20-7-5-6-16(26-20)13-33-17-10-11-32-14-17;2*1-15-8-9-18(33-15)21-27-23(29-24(2,3)4)28-22-19(12-25-30(21)22)34-20-7-5-6-16(26-20)13-32-17-10-11-31-14-17;1-6-17(24)18-9-7-8-16(26-18)12-15-13-25-30-20(15)27-22(29-23(3,4)5)28-21(30)19-11-10-14(2)31-19;1-6-18(30)17-9-7-8-16(25-17)12-15-13-24-29-20(15)26-22(28-23(3,4)5)27-21(29)19-11-10-14(2)31-19;1-6-8-17-9-7-10-18(25-17)13-16-14-24-29-20(16)26-22(28-23(3,4)5)27-21(29)19-12-11-15(2)30-19;1-12-9-10-16(28-12)18-25-19(26-20(2,3)4)24-17-15(11-22-27(17)18)23-14-8-6-5-7-13(14)21;1-20(2,3)25-19-23-17-14(16(27)12-6-4-7-13(21)10-12)11-22-26(17)18(24-19)15-8-5-9-28-15;1-20(2,3)25-19-23-17-14(10-13-6-4-7-15(21)11-13)12-22-26(17)18(24-19)16-8-5-9-27-16/h5-9,12,17,28H,10-11,13-14H2,1-4H3,(H,29,31);5-9,12,17H,10-11,13-14H2,1-4H3,(H,26,27)(H,28,30);2*5-9,12,17H,10-11,13-14H2,1-4H3,(H,28,29);7-11,13,17H,6,12H2,1-5H3,(H,27,29);7-11,13,18,30H,6,12H2,1-5H3,(H,26,28);7,9-12,14H,6,8,13H2,1-5H3,(H,26,28);5-11,23H,1-4H3,(H,24,26);4-11,16,27H,1-3H3,(H,23,25);4-9,11-12H,10H2,1-3H3,(H,23,25)/t4*17-;;;;;;/m0000....../s1
InChIKeyODNAKBOLVOWAKJ-YHUPPDITSA-N
XLogP46.27
TPSA919.46 Ų
H-Bond Donors15
H-Bond Acceptors81
Rotatable Bonds58
Heavy Atoms312
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004280.45
LogP ≤ 546.27
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1081

Analyze [2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of [2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine?
The IUPAC name of [2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine (CID 159962531) is [2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine.
What is the SMILES notation for [2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine?
The canonical SMILES for [2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine is CC(C)(C)Nc1nc(-c2ccco2)n2ncc(C(O)c3cccc(F)c3)c2n1.CC(C)(C)Nc1nc(-c2ccco2)n2ncc(Cc3cccc(F)c3)c2n1.CCC(Cl)c1cccc(Cc2cnn3c(-c4ccc(C)o4)nc(NC(C)(C)C)nc23)n1.CCC(O)c1cccc(Cc2cnn3c(-c4ccc(C)o4)nc(NC(C)(C)C)nc23)n1.CCCc1cccc(Cc2cnn3c(-c4ccc(C)o4)nc(NC(C)(C)C)nc23)n1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Nc4cccc(CO[C@H]5CCOC5)c4F)cnn23)o1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Nc4cccc(CO[C@H]5CCOC5)n4)cnn23)o1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Nc4ccccc4F)cnn23)o1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Oc4cccc(CO[C@H]5CCOC5)n4)cnn23)o1.Cc1ccc(-c2nc(NC(C)(C)C)nc3c(Sc4cccc(CO[C@H]5CCOC5)n4)cnn23)o1.
What is the InChIKey of [2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine?
The InChIKey is ODNAKBOLVOWAKJ-YHUPPDITSA-N. The full InChI is InChI=1S/C25H29FN6O3.C24H29N7O3.C24H28N6O4.C24H28N6O3S.C23H27ClN6O.C23H28N6O2.C23H28N6O.C20H21FN6O.C20H20FN5O2.C20H20FN5O/c1-15-8-9-20(35-15)23-30-24(31-25(2,3)4)29-22-19(12-27-32(22)23)28-18-7-5-6-16(21(18)26)13-34-17-10-11-33-14-17;1-15-8-9-19(34-15)22-29-23(30-24(2,3)4)28-21-18(12-25-31(21)22)27-20-7-5-6-16(26-20)13-33-17-10-11-32-14-17;2*1-15-8-9-18(33-15)21-27-23(29-24(2,3)4)28-22-19(12-25-30(21)22)34-20-7-5-6-16(26-20)13-32-17-10-11-31-14-17;1-6-17(24)18-9-7-8-16(26-18)12-15-13-25-30-20(15)27-22(29-23(3,4)5)28-21(30)19-11-10-14(2)31-19;1-6-18(30)17-9-7-8-16(25-17)12-15-13-24-29-20(15)26-22(28-23(3,4)5)27-21(29)19-11-10-14(2)31-19;1-6-8-17-9-7-10-18(25-17)13-16-14-24-29-20(16)26-22(28-23(3,4)5)27-21(29)19-12-11-15(2)30-19;1-12-9-10-16(28-12)18-25-19(26-20(2,3)4)24-17-15(11-22-27(17)18)23-14-8-6-5-7-13(14)21;1-20(2,3)25-19-23-17-14(16(27)12-6-4-7-13(21)10-12)11-22-26(17)18(24-19)15-8-5-9-28-15;1-20(2,3)25-19-23-17-14(10-13-6-4-7-15(21)11-13)12-22-26(17)18(24-19)16-8-5-9-27-16/h5-9,12,17,28H,10-11,13-14H2,1-4H3,(H,29,31);5-9,12,17H,10-11,13-14H2,1-4H3,(H,26,27)(H,28,30);2*5-9,12,17H,10-11,13-14H2,1-4H3,(H,28,29);7-11,13,17H,6,12H2,1-5H3,(H,27,29);7-11,13,18,30H,6,12H2,1-5H3,(H,26,28);7,9-12,14H,6,8,13H2,1-5H3,(H,26,28);5-11,23H,1-4H3,(H,24,26);4-11,16,27H,1-3H3,(H,23,25);4-9,11-12H,10H2,1-3H3,(H,23,25)/t4*17-;;;;;;/m0000....../s1.
What are the key properties of [2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine?
[2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine has a molecular weight of 4280.45 g/mol, XLogP of 46.27, 58 rotatable bonds, 15 hydrogen bond donors, and 81 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(tert-butylamino)-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]-(3-fluorophenyl)methanol;1-[6-[[2-(tert-butylamino)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-pyridinyl]propan-1-ol;N-tert-butyl-8-[[6-(1-chloropropyl)-2-pyridinyl]methyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-[2-fluoro-3-[[(3S)-oxolan-3-yl]oxymethyl]phenyl]-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-8-[(3-fluorophenyl)methyl]-4-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-8-N-(2-fluorophenyl)-4-(5-methylfuran-2-yl)pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]oxy]pyrazolo[1,5-a][1,3,5]triazin-2-amine;2-N-tert-butyl-4-(5-methylfuran-2-yl)-8-N-[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]pyrazolo[1,5-a][1,3,5]triazine-2,8-diamine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine;N-tert-butyl-4-(5-methylfuran-2-yl)-8-[(6-propyl-2-pyridinyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-amine is sourced from PubChem (CID 159962531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).