4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one

C181H122F16N32O8 — CID 158852051

About 4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one

4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one (PubChem CID 158852051) has the molecular formula C181H122F16N32O8 and a molecular weight of 3177.15 g/mol. Its IUPAC name is 4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one.

Molecular Properties

• Compound Name: 4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one
• PubChem CID: 158852051
• Molecular Formula: C181H122F16N32O8
• Molecular Weight: 3177.15 g/mol
• Exact Mass: 3174.99
• IUPAC Name: 4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one
• SMILES: C=C1Cc2cc(-c3cc(F)c(Cn4c(=O)cnc5ccncc54)c(F)c3)ccc2N1.CC1=CCc2cc(-c3cc(F)c(Cn4c(=O)cnc5ccncc54)c(F)c3)ccc21.Cn1cc2cc(-c3cc(F)c(Cn4c(=O)cnc5ccncc54)c(F)c3)ccc2n1.Cn1cc2cccc(-c3cc(F)c(Cn4c(=O)cnc5ccncc54)c(F)c3)c2c1.Cn1cnc2ccc(-c3cc(F)c(Cn4c(=O)cnc5ccncc54)c(F)c3)cc21.O=c1cnc2ccncc2n1Cc1c(F)cc(-c2ccc3[nH]ccc3c2)cc1F.O=c1cnc2ccncc2n1Cc1c(F)cc(-c2ccc3c(c2)CC=C3)cc1F.O=c1cnc2ccncc2n1Cc1c(F)cc(-c2cccc3c2C=NC3)cc1F
• InChI: InChI=1S/C24H17F2N3O.2C23H16F2N4O.C23H15F2N3O.2C22H15F2N5O.2C22H14F2N4O/c1-14-2-3-16-8-15(4-5-18(14)16)17-9-20(25)19(21(26)10-17)13-29-23-11-27-7-6-22(23)28-12-24(29)30;1-13-6-16-7-14(2-3-20(16)28-13)15-8-18(24)17(19(25)9-15)12-29-22-10-26-5-4-21(22)27-11-23(29)30;1-28-11-14-3-2-4-16(17(14)12-28)15-7-19(24)18(20(25)8-15)13-29-22-9-26-6-5-21(22)27-10-23(29)30;24-19-9-17(16-5-4-14-2-1-3-15(14)8-16)10-20(25)18(19)13-28-22-11-26-7-6-21(22)27-12-23(28)29;1-28-12-27-18-3-2-13(8-20(18)28)14-6-16(23)15(17(24)7-14)11-29-21-9-25-5-4-19(21)26-10-22(29)30;1-28-11-15-6-13(2-3-19(15)27-28)14-7-17(23)16(18(24)8-14)12-29-21-9-25-5-4-20(21)26-10-22(29)30;23-17-8-15(13-1-2-19-14(7-13)3-6-26-19)9-18(24)16(17)12-28-21-10-25-5-4-20(21)27-11-22(28)29;23-18-6-14(15-3-1-2-13-8-26-9-16(13)15)7-19(24)17(18)12-28-21-10-25-5-4-20(21)27-11-22(28)29/h2,4-12H,3,13H2,1H3;2-5,7-11,28H,1,6,12H2;2-12H,13H2,1H3;1-2,4-12H,3,13H2;2-10,12H,11H2,1H3;2-11H,12H2,1H3;1-11,26H,12H2;1-7,9-11H,8,12H2
• InChIKey: IZORNBQFLUAIOD-UHFFFAOYSA-N
• XLogP: 32.97
• TPSA: 462.99 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 39
• Rotatable Bonds: 24
• Heavy Atoms: 237
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3177.15
LogP ≤ 5	32.97
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	39

Frequently Asked Questions

What is the IUPAC name of 4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one?

The IUPAC name of 4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one (CID 158852051) is 4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one.

What is the SMILES notation for 4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one?

The canonical SMILES for 4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one is C=C1Cc2cc(-c3cc(F)c(Cn4c(=O)cnc5ccncc54)c(F)c3)ccc2N1.CC1=CCc2cc(-c3cc(F)c(Cn4c(=O)cnc5ccncc54)c(F)c3)ccc21.Cn1cc2cc(-c3cc(F)c(Cn4c(=O)cnc5ccncc54)c(F)c3)ccc2n1.Cn1cc2cccc(-c3cc(F)c(Cn4c(=O)cnc5ccncc54)c(F)c3)c2c1.Cn1cnc2ccc(-c3cc(F)c(Cn4c(=O)cnc5ccncc54)c(F)c3)cc21.O=c1cnc2ccncc2n1Cc1c(F)cc(-c2ccc3[nH]ccc3c2)cc1F.O=c1cnc2ccncc2n1Cc1c(F)cc(-c2ccc3c(c2)CC=C3)cc1F.O=c1cnc2ccncc2n1Cc1c(F)cc(-c2cccc3c2C=NC3)cc1F.

What is the InChIKey of 4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one?

The InChIKey is IZORNBQFLUAIOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17F2N3O.2C23H16F2N4O.C23H15F2N3O.2C22H15F2N5O.2C22H14F2N4O/c1-14-2-3-16-8-15(4-5-18(14)16)17-9-20(25)19(21(26)10-17)13-29-23-11-27-7-6-22(23)28-12-24(29)30;1-13-6-16-7-14(2-3-20(16)28-13)15-8-18(24)17(19(25)9-15)12-29-22-10-26-5-4-21(22)27-11-23(29)30;1-28-11-14-3-2-4-16(17(14)12-28)15-7-19(24)18(20(25)8-15)13-29-22-9-26-6-5-21(22)27-10-23(29)30;24-19-9-17(16-5-4-14-2-1-3-15(14)8-16)10-20(25)18(19)13-28-22-11-26-7-6-21(22)27-12-23(28)29;1-28-12-27-18-3-2-13(8-20(18)28)14-6-16(23)15(17(24)7-14)11-29-21-9-25-5-4-19(21)26-10-22(29)30;1-28-11-15-6-13(2-3-19(15)27-28)14-7-17(23)16(18(24)8-14)12-29-21-9-25-5-4-20(21)26-10-22(29)30;23-17-8-15(13-1-2-19-14(7-13)3-6-26-19)9-18(24)16(17)12-28-21-10-25-5-4-20(21)27-11-22(28)29;23-18-6-14(15-3-1-2-13-8-26-9-16(13)15)7-19(24)17(18)12-28-21-10-25-5-4-20(21)27-11-22(28)29/h2,4-12H,3,13H2,1H3;2-5,7-11,28H,1,6,12H2;2-12H,13H2,1H3;1-2,4-12H,3,13H2;2-10,12H,11H2,1H3;2-11H,12H2,1H3;1-11,26H,12H2;1-7,9-11H,8,12H2.

What are the key properties of 4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one?

4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one has a molecular weight of 3177.15 g/mol, XLogP of 32.97, 24 rotatable bonds, 2 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[[2,6-difluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one;4-[[2,6-difluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-3-one is sourced from PubChem (CID 158852051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).