(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile

C140H119Br3Cl2F21N31O8 — CID 159744310

IUPAC(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
SMILESCOc1ccc2nnc(C(=O)N3CCC(c4cc(C(C)(F)F)cc(C(F)(F)F)c4)CC3)n2c1.Cc1cc(F)c(C(F)(F)F)c(C2CCN(C(=O)c3nnc4ccc(Br)cn34)CC2)c1.Cc1ccc(C(F)(F)F)c(C2CCN(C(=O)c3nnc4ccc(Br)cn34)CC2)c1.Cc1ccc(Cl)c(C2CCN(C(=O)c3nnc4ccc(C#N)cn34)CC2)c1.N#Cc1ccc2nnc(C(=O)N3CCC(c4c(F)cccc4C(F)(F)F)CC3)n2c1.N#Cc1ccc2nnc(C(=O)N3CCC(c4cccc(F)c4Cl)CC3)n2c1.O=C(c1nnc2ccc(Br)cn12)N1CCC(c2c(F)cccc2C(F)(F)F)CC1
InChIInChI=1S/C22H21F5N4O2.C20H17BrF4N4O.C20H18BrF3N4O.C20H18ClN5O.C20H15F4N5O.C19H15BrF4N4O.C19H15ClFN5O/c1-21(23,24)15-9-14(10-16(11-15)22(25,26)27)13-5-7-30(8-6-13)20(32)19-29-28-18-4-3-17(33-2)12-31(18)19;1-11-8-14(17(15(22)9-11)20(23,24)25)12-4-6-28(7-5-12)19(30)18-27-26-16-3-2-13(21)10-29(16)18;1-12-2-4-16(20(22,23)24)15(10-12)13-6-8-27(9-7-13)19(29)18-26-25-17-5-3-14(21)11-28(17)18;1-13-2-4-17(21)16(10-13)15-6-8-25(9-7-15)20(27)19-24-23-18-5-3-14(11-22)12-26(18)19;21-15-3-1-2-14(20(22,23)24)17(15)13-6-8-28(9-7-13)19(30)18-27-26-16-5-4-12(10-25)11-29(16)18;20-12-4-5-15-25-26-17(28(15)10-12)18(29)27-8-6-11(7-9-27)16-13(19(22,23)24)2-1-3-14(16)21;20-17-14(2-1-3-15(17)21)13-6-8-25(9-7-13)19(27)18-24-23-16-5-4-12(10-22)11-26(16)18/h3-4,9-13H,5-8H2,1-2H3;2-3,8-10,12H,4-7H2,1H3;2-5,10-11,13H,6-9H2,1H3;2-5,10,12,15H,6-9H2,1H3;1-5,11,13H,6-9H2;1-5,10-11H,6-9H2;1-5,11,13H,6-9H2
InChIKeyNCVSLFGTRNTNQI-UHFFFAOYSA-N
MW3073.28 g/mol
LogP30.15
Rot. Bonds16

About (6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile

(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile (PubChem CID 159744310) has the molecular formula C140H119Br3Cl2F21N31O8 and a molecular weight of 3073.28 g/mol. Its IUPAC name is (6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile.

Molecular Properties

Compound Name(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
PubChem CID159744310
Molecular FormulaC140H119Br3Cl2F21N31O8
Molecular Weight3073.28 g/mol
Exact Mass3067.64
IUPAC Name(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
SMILESCOc1ccc2nnc(C(=O)N3CCC(c4cc(C(C)(F)F)cc(C(F)(F)F)c4)CC3)n2c1.Cc1cc(F)c(C(F)(F)F)c(C2CCN(C(=O)c3nnc4ccc(Br)cn34)CC2)c1.Cc1ccc(C(F)(F)F)c(C2CCN(C(=O)c3nnc4ccc(Br)cn34)CC2)c1.Cc1ccc(Cl)c(C2CCN(C(=O)c3nnc4ccc(C#N)cn34)CC2)c1.N#Cc1ccc2nnc(C(=O)N3CCC(c4c(F)cccc4C(F)(F)F)CC3)n2c1.N#Cc1ccc2nnc(C(=O)N3CCC(c4cccc(F)c4Cl)CC3)n2c1.O=C(c1nnc2ccc(Br)cn12)N1CCC(c2c(F)cccc2C(F)(F)F)CC1
InChIInChI=1S/C22H21F5N4O2.C20H17BrF4N4O.C20H18BrF3N4O.C20H18ClN5O.C20H15F4N5O.C19H15BrF4N4O.C19H15ClFN5O/c1-21(23,24)15-9-14(10-16(11-15)22(25,26)27)13-5-7-30(8-6-13)20(32)19-29-28-18-4-3-17(33-2)12-31(18)19;1-11-8-14(17(15(22)9-11)20(23,24)25)12-4-6-28(7-5-12)19(30)18-27-26-16-3-2-13(21)10-29(16)18;1-12-2-4-16(20(22,23)24)15(10-12)13-6-8-27(9-7-13)19(29)18-26-25-17-5-3-14(21)11-28(17)18;1-13-2-4-17(21)16(10-13)15-6-8-25(9-7-15)20(27)19-24-23-18-5-3-14(11-22)12-26(18)19;21-15-3-1-2-14(20(22,23)24)17(15)13-6-8-28(9-7-13)19(30)18-27-26-16-5-4-12(10-25)11-29(16)18;20-12-4-5-15-25-26-17(28(15)10-12)18(29)27-8-6-11(7-9-27)16-13(19(22,23)24)2-1-3-14(16)21;20-17-14(2-1-3-15(17)21)13-6-8-25(9-7-13)19(27)18-24-23-16-5-4-12(10-22)11-26(16)18/h3-4,9-13H,5-8H2,1-2H3;2-3,8-10,12H,4-7H2,1H3;2-5,10-11,13H,6-9H2,1H3;2-5,10,12,15H,6-9H2,1H3;1-5,11,13H,6-9H2;1-5,10-11H,6-9H2;1-5,11,13H,6-9H2
InChIKeyNCVSLFGTRNTNQI-UHFFFAOYSA-N
XLogP30.15
TPSA434.10 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds16
Heavy Atoms205
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003073.28
LogP ≤ 530.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Analyze (6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of (6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile?
The IUPAC name of (6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile (CID 159744310) is (6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile.
What is the SMILES notation for (6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile?
The canonical SMILES for (6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile is COc1ccc2nnc(C(=O)N3CCC(c4cc(C(C)(F)F)cc(C(F)(F)F)c4)CC3)n2c1.Cc1cc(F)c(C(F)(F)F)c(C2CCN(C(=O)c3nnc4ccc(Br)cn34)CC2)c1.Cc1ccc(C(F)(F)F)c(C2CCN(C(=O)c3nnc4ccc(Br)cn34)CC2)c1.Cc1ccc(Cl)c(C2CCN(C(=O)c3nnc4ccc(C#N)cn34)CC2)c1.N#Cc1ccc2nnc(C(=O)N3CCC(c4c(F)cccc4C(F)(F)F)CC3)n2c1.N#Cc1ccc2nnc(C(=O)N3CCC(c4cccc(F)c4Cl)CC3)n2c1.O=C(c1nnc2ccc(Br)cn12)N1CCC(c2c(F)cccc2C(F)(F)F)CC1.
What is the InChIKey of (6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile?
The InChIKey is NCVSLFGTRNTNQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21F5N4O2.C20H17BrF4N4O.C20H18BrF3N4O.C20H18ClN5O.C20H15F4N5O.C19H15BrF4N4O.C19H15ClFN5O/c1-21(23,24)15-9-14(10-16(11-15)22(25,26)27)13-5-7-30(8-6-13)20(32)19-29-28-18-4-3-17(33-2)12-31(18)19;1-11-8-14(17(15(22)9-11)20(23,24)25)12-4-6-28(7-5-12)19(30)18-27-26-16-3-2-13(21)10-29(16)18;1-12-2-4-16(20(22,23)24)15(10-12)13-6-8-27(9-7-13)19(29)18-26-25-17-5-3-14(21)11-28(17)18;1-13-2-4-17(21)16(10-13)15-6-8-25(9-7-15)20(27)19-24-23-18-5-3-14(11-22)12-26(18)19;21-15-3-1-2-14(20(22,23)24)17(15)13-6-8-28(9-7-13)19(30)18-27-26-16-5-4-12(10-25)11-29(16)18;20-12-4-5-15-25-26-17(28(15)10-12)18(29)27-8-6-11(7-9-27)16-13(19(22,23)24)2-1-3-14(16)21;20-17-14(2-1-3-15(17)21)13-6-8-25(9-7-13)19(27)18-24-23-16-5-4-12(10-22)11-26(16)18/h3-4,9-13H,5-8H2,1-2H3;2-3,8-10,12H,4-7H2,1H3;2-5,10-11,13H,6-9H2,1H3;2-5,10,12,15H,6-9H2,1H3;1-5,11,13H,6-9H2;1-5,10-11H,6-9H2;1-5,11,13H,6-9H2.
What are the key properties of (6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile?
(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile has a molecular weight of 3073.28 g/mol, XLogP of 30.15, 16 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for (6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[3-fluoro-5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-[4-[5-methyl-2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;3-[4-(2-chloro-3-fluorophenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-[4-(2-chloro-5-methylphenyl)piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;[4-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]piperidin-1-yl]-(6-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone;3-[4-[2-fluoro-6-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile is sourced from PubChem (CID 159744310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).