1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one

C141H120F7N41O7 — CID 157295281

IUPAC1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one
SMILESCc1ccc(F)c(CC(=O)Cc2ccc(-c3cccc4nnc(N)n34)cn2)c1.Cc1ccc(F)c(CC(=O)Cc2ccc(-c3cccc4nnc(N)n34)nc2)c1.Cc1ccc(F)c(CC(=O)Cc2ccc(-c3cccc4nnc(N)n34)nn2)c1.Cc1ccc(F)c(CC(=O)Cc2cnc(-c3cccc4nnc(N)n34)cn2)c1.Cc1ccc(F)c(CC(=O)Cc2cnc(-c3cccc4nnc(N)n34)nc2)c1.Cc1ccc(F)c(CC(=O)Cc2cnc(-c3cccc4nnc(N)n34)nn2)c1.Cc1ccc(F)c(CC(=O)Cc2ncc(-c3cccc4nnc(N)n34)cn2)c1
InChIInChI=1S/2C21H18FN5O.4C20H17FN6O.C19H16FN7O/c1-13-5-8-18(22)15(9-13)10-17(28)11-16-7-6-14(12-24-16)19-3-2-4-20-25-26-21(23)27(19)20;1-13-5-7-17(22)15(9-13)11-16(28)10-14-6-8-18(24-12-14)19-3-2-4-20-25-26-21(23)27(19)20;1-12-5-7-16(21)13(9-12)10-15(28)11-14-6-8-17(24-23-14)18-3-2-4-19-25-26-20(22)27(18)19;1-12-5-6-16(21)14(7-12)9-15(28)8-13-10-23-19(24-11-13)17-3-2-4-18-25-26-20(22)27(17)18;1-12-5-6-16(21)13(7-12)8-15(28)9-18-23-10-14(11-24-18)17-3-2-4-19-25-26-20(22)27(17)19;1-12-5-6-16(21)13(7-12)8-15(28)9-14-10-24-17(11-23-14)18-3-2-4-19-25-26-20(22)27(18)19;1-11-5-6-15(20)12(7-11)8-14(28)9-13-10-22-18(25-23-13)16-3-2-4-17-24-26-19(21)27(16)17/h2*2-9,12H,10-11H2,1H3,(H2,23,26);2-9H,10-11H2,1H3,(H2,22,26);3*2-7,10-11H,8-9H2,1H3,(H2,22,26);2-7,10H,8-9H2,1H3,(H2,21,26)
InChIKeyBBGSZFDAIBVVOW-UHFFFAOYSA-N
MW2633.78 g/mol
LogP18.60
Rot. Bonds35

About 1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one

1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one (PubChem CID 157295281) has the molecular formula C141H120F7N41O7 and a molecular weight of 2633.78 g/mol. Its IUPAC name is 1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one.

Molecular Properties

Compound Name1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one
PubChem CID157295281
Molecular FormulaC141H120F7N41O7
Molecular Weight2633.78 g/mol
Exact Mass2632.02
IUPAC Name1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one
SMILESCc1ccc(F)c(CC(=O)Cc2ccc(-c3cccc4nnc(N)n34)cn2)c1.Cc1ccc(F)c(CC(=O)Cc2ccc(-c3cccc4nnc(N)n34)nc2)c1.Cc1ccc(F)c(CC(=O)Cc2ccc(-c3cccc4nnc(N)n34)nn2)c1.Cc1ccc(F)c(CC(=O)Cc2cnc(-c3cccc4nnc(N)n34)cn2)c1.Cc1ccc(F)c(CC(=O)Cc2cnc(-c3cccc4nnc(N)n34)nc2)c1.Cc1ccc(F)c(CC(=O)Cc2cnc(-c3cccc4nnc(N)n34)nn2)c1.Cc1ccc(F)c(CC(=O)Cc2ncc(-c3cccc4nnc(N)n34)cn2)c1
InChIInChI=1S/2C21H18FN5O.4C20H17FN6O.C19H16FN7O/c1-13-5-8-18(22)15(9-13)10-17(28)11-16-7-6-14(12-24-16)19-3-2-4-20-25-26-21(23)27(19)20;1-13-5-7-17(22)15(9-13)11-16(28)10-14-6-8-18(24-12-14)19-3-2-4-20-25-26-21(23)27(19)20;1-12-5-7-16(21)13(9-12)10-15(28)11-14-6-8-17(24-23-14)18-3-2-4-19-25-26-20(22)27(18)19;1-12-5-6-16(21)14(7-12)9-15(28)8-13-10-23-19(24-11-13)17-3-2-4-18-25-26-20(22)27(17)18;1-12-5-6-16(21)13(7-12)8-15(28)9-18-23-10-14(11-24-18)17-3-2-4-19-25-26-20(22)27(17)19;1-12-5-6-16(21)13(7-12)8-15(28)9-14-10-24-17(11-23-14)18-3-2-4-19-25-26-20(22)27(18)19;1-11-5-6-15(20)12(7-11)8-14(28)9-13-10-22-18(25-23-13)16-3-2-4-17-24-26-19(21)27(16)17/h2*2-9,12H,10-11H2,1H3,(H2,23,26);2-9H,10-11H2,1H3,(H2,22,26);3*2-7,10-11H,8-9H2,1H3,(H2,22,26);2-7,10H,8-9H2,1H3,(H2,21,26)
InChIKeyBBGSZFDAIBVVOW-UHFFFAOYSA-N
XLogP18.60
TPSA680.53 Ų
H-Bond Donors7
H-Bond Acceptors48
Rotatable Bonds35
Heavy Atoms196
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002633.78
LogP ≤ 518.60
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1048

Analyze 1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one?
The IUPAC name of 1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one (CID 157295281) is 1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one.
What is the SMILES notation for 1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one?
The canonical SMILES for 1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one is Cc1ccc(F)c(CC(=O)Cc2ccc(-c3cccc4nnc(N)n34)cn2)c1.Cc1ccc(F)c(CC(=O)Cc2ccc(-c3cccc4nnc(N)n34)nc2)c1.Cc1ccc(F)c(CC(=O)Cc2ccc(-c3cccc4nnc(N)n34)nn2)c1.Cc1ccc(F)c(CC(=O)Cc2cnc(-c3cccc4nnc(N)n34)cn2)c1.Cc1ccc(F)c(CC(=O)Cc2cnc(-c3cccc4nnc(N)n34)nc2)c1.Cc1ccc(F)c(CC(=O)Cc2cnc(-c3cccc4nnc(N)n34)nn2)c1.Cc1ccc(F)c(CC(=O)Cc2ncc(-c3cccc4nnc(N)n34)cn2)c1.
What is the InChIKey of 1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one?
The InChIKey is BBGSZFDAIBVVOW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C21H18FN5O.4C20H17FN6O.C19H16FN7O/c1-13-5-8-18(22)15(9-13)10-17(28)11-16-7-6-14(12-24-16)19-3-2-4-20-25-26-21(23)27(19)20;1-13-5-7-17(22)15(9-13)11-16(28)10-14-6-8-18(24-12-14)19-3-2-4-20-25-26-21(23)27(19)20;1-12-5-7-16(21)13(9-12)10-15(28)11-14-6-8-17(24-23-14)18-3-2-4-19-25-26-20(22)27(18)19;1-12-5-6-16(21)14(7-12)9-15(28)8-13-10-23-19(24-11-13)17-3-2-4-18-25-26-20(22)27(17)18;1-12-5-6-16(21)13(7-12)8-15(28)9-18-23-10-14(11-24-18)17-3-2-4-19-25-26-20(22)27(17)19;1-12-5-6-16(21)13(7-12)8-15(28)9-14-10-24-17(11-23-14)18-3-2-4-19-25-26-20(22)27(18)19;1-11-5-6-15(20)12(7-11)8-14(28)9-13-10-22-18(25-23-13)16-3-2-4-17-24-26-19(21)27(16)17/h2*2-9,12H,10-11H2,1H3,(H2,23,26);2-9H,10-11H2,1H3,(H2,22,26);3*2-7,10-11H,8-9H2,1H3,(H2,22,26);2-7,10H,8-9H2,1H3,(H2,21,26).
What are the key properties of 1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one?
1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one has a molecular weight of 2633.78 g/mol, XLogP of 18.60, 35 rotatable bonds, 7 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrazin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyridazin-3-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-2-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[6-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-3-pyridinyl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[2-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-5-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[5-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)pyrimidin-2-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one;1-[3-(3-amino-[1,2,4]triazolo[4,3-a]pyridin-5-yl)-1,2,4-triazin-6-yl]-3-(2-fluoro-5-methylphenyl)propan-2-one is sourced from PubChem (CID 157295281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).