1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid

C139H121F21N32O18S — CID 159638874

IUPAC1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid
SMILESCCOCCn1cc(C(=O)Nc2ccc(-n3nc(C4CCOCC4)cc3C(F)(F)F)nn2)ccc1=O.CCOCCn1cc(C(=O)Nc2ccc(-n3nc(OCC)cc3C(F)(F)F)cn2)ccc1=O.CCOc1ccccc1CNC(=O)NCc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)cc1.CNS(=O)(=O)c1ccc(C(=O)Nc2ccc(-n3nc(-c4cccnc4)cc3C(F)(F)F)cn2)cc1.O=C(NCc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)cc1)NCc1ccccc1OC(F)(F)F.O=C(O)c1ccc(C(=O)Nc2ccc(-n3nc(-c4cccnc4)cc3C(F)(F)F)cn2)cc1
InChIInChI=1S/C26H24F3N5O2.C25H19F6N5O2.C23H25F3N6O4.C22H17F3N6O3S.C22H14F3N5O3.C21H22F3N5O4/c1-2-36-23-8-4-3-6-20(23)17-32-25(35)31-15-18-9-11-21(12-10-18)34-24(26(27,28)29)14-22(33-34)19-7-5-13-30-16-19;26-24(27,28)22-12-20(17-5-3-11-32-14-17)35-36(22)19-9-7-16(8-10-19)13-33-23(37)34-15-18-4-1-2-6-21(18)38-25(29,30)31;1-2-35-12-9-31-14-16(3-6-21(31)33)22(34)27-19-4-5-20(29-28-19)32-18(23(24,25)26)13-17(30-32)15-7-10-36-11-8-15;1-26-35(33,34)17-7-4-14(5-8-17)21(32)29-20-9-6-16(13-28-20)31-19(22(23,24)25)11-18(30-31)15-3-2-10-27-12-15;23-22(24,25)18-10-17(15-2-1-9-26-11-15)29-30(18)16-7-8-19(27-12-16)28-20(31)13-3-5-14(6-4-13)21(32)33;1-3-32-10-9-28-13-14(5-8-19(28)30)20(31)26-17-7-6-15(12-25-17)29-16(21(22,23)24)11-18(27-29)33-4-2/h3-14,16H,2,15,17H2,1H3,(H2,31,32,35);1-12,14H,13,15H2,(H2,33,34,37);3-6,13-15H,2,7-12H2,1H3,(H,27,28,34);2-13,26H,1H3,(H,28,29,32);1-12H,(H,32,33)(H,27,28,31);5-8,11-13H,3-4,9-10H2,1-2H3,(H,25,26,31)
InChIKeyMQBZJDZNAOQLSA-UHFFFAOYSA-N
MW2958.73 g/mol
LogP25.17
Rot. Bonds43

About 1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid

1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid (PubChem CID 159638874) has the molecular formula C139H121F21N32O18S and a molecular weight of 2958.73 g/mol. Its IUPAC name is 1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid.

Molecular Properties

Compound Name1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid
PubChem CID159638874
Molecular FormulaC139H121F21N32O18S
Molecular Weight2958.73 g/mol
Exact Mass2956.89
IUPAC Name1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid
SMILESCCOCCn1cc(C(=O)Nc2ccc(-n3nc(C4CCOCC4)cc3C(F)(F)F)nn2)ccc1=O.CCOCCn1cc(C(=O)Nc2ccc(-n3nc(OCC)cc3C(F)(F)F)cn2)ccc1=O.CCOc1ccccc1CNC(=O)NCc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)cc1.CNS(=O)(=O)c1ccc(C(=O)Nc2ccc(-n3nc(-c4cccnc4)cc3C(F)(F)F)cn2)cc1.O=C(NCc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)cc1)NCc1ccccc1OC(F)(F)F.O=C(O)c1ccc(C(=O)Nc2ccc(-n3nc(-c4cccnc4)cc3C(F)(F)F)cn2)cc1
InChIInChI=1S/C26H24F3N5O2.C25H19F6N5O2.C23H25F3N6O4.C22H17F3N6O3S.C22H14F3N5O3.C21H22F3N5O4/c1-2-36-23-8-4-3-6-20(23)17-32-25(35)31-15-18-9-11-21(12-10-18)34-24(26(27,28)29)14-22(33-34)19-7-5-13-30-16-19;26-24(27,28)22-12-20(17-5-3-11-32-14-17)35-36(22)19-9-7-16(8-10-19)13-33-23(37)34-15-18-4-1-2-6-21(18)38-25(29,30)31;1-2-35-12-9-31-14-16(3-6-21(31)33)22(34)27-19-4-5-20(29-28-19)32-18(23(24,25)26)13-17(30-32)15-7-10-36-11-8-15;1-26-35(33,34)17-7-4-14(5-8-17)21(32)29-20-9-6-16(13-28-20)31-19(22(23,24)25)11-18(30-31)15-3-2-10-27-12-15;23-22(24,25)18-10-17(15-2-1-9-26-11-15)29-30(18)16-7-8-19(27-12-16)28-20(31)13-3-5-14(6-4-13)21(32)33;1-3-32-10-9-28-13-14(5-8-19(28)30)20(31)26-17-7-6-15(12-25-17)29-16(21(22,23)24)11-18(27-29)33-4-2/h3-14,16H,2,15,17H2,1H3,(H2,31,32,35);1-12,14H,13,15H2,(H2,33,34,37);3-6,13-15H,2,7-12H2,1H3,(H,27,28,34);2-13,26H,1H3,(H,28,29,32);1-12H,(H,32,33)(H,27,28,31);5-8,11-13H,3-4,9-10H2,1-2H3,(H,25,26,31)
InChIKeyMQBZJDZNAOQLSA-UHFFFAOYSA-N
XLogP25.17
TPSA604.44 Ų
H-Bond Donors10
H-Bond Acceptors40
Rotatable Bonds43
Heavy Atoms211
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002958.73
LogP ≤ 525.17
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 89354167
CID 89354167
ethane;4-[3-[[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]carbamoyl]phenyl]benzoic acid
CID 143484283
N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-(2,2,2-trifluoroethyl)benzamide
CID 89354274
N-[5-(5-methyl-3-pyridin-3-ylpyrazol-1-yl)-2-pyridinyl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 129255074
6-morpholin-4-yl-N-[5-[3-propoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]cyclohepta-1,3,6-triene-1-carboxamide
CID 143484561
2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide
CID 121101067
N-[5-(5-methyl-3-pyridin-3-ylpyrazol-1-yl)-2-pyridinyl]pyrimidine-5-carboxamide
CID 129255075
3-N-phenyl-3-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzene-1,3-dicarboxamide
CID 154321064
3-(methylsulfamoyl)-N-[[2-(trifluoromethoxy)phenyl]methyl]benzamide
CID 34553753
(2Z)-2-aminooxy-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]penta-2,4-dienamide
CID 89354169
N-[(2-ethoxyphenyl)methyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide
CID 43908455
N-butyl-4-[[[2-(trifluoromethoxy)phenyl]methylcarbamoylamino]methyl]benzamide
CID 112829565

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid?
The IUPAC name of 1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid (CID 159638874) is 1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid.
What is the SMILES notation for 1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid?
The canonical SMILES for 1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid is CCOCCn1cc(C(=O)Nc2ccc(-n3nc(C4CCOCC4)cc3C(F)(F)F)nn2)ccc1=O.CCOCCn1cc(C(=O)Nc2ccc(-n3nc(OCC)cc3C(F)(F)F)cn2)ccc1=O.CCOc1ccccc1CNC(=O)NCc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)cc1.CNS(=O)(=O)c1ccc(C(=O)Nc2ccc(-n3nc(-c4cccnc4)cc3C(F)(F)F)cn2)cc1.O=C(NCc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)cc1)NCc1ccccc1OC(F)(F)F.O=C(O)c1ccc(C(=O)Nc2ccc(-n3nc(-c4cccnc4)cc3C(F)(F)F)cn2)cc1.
What is the InChIKey of 1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid?
The InChIKey is MQBZJDZNAOQLSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24F3N5O2.C25H19F6N5O2.C23H25F3N6O4.C22H17F3N6O3S.C22H14F3N5O3.C21H22F3N5O4/c1-2-36-23-8-4-3-6-20(23)17-32-25(35)31-15-18-9-11-21(12-10-18)34-24(26(27,28)29)14-22(33-34)19-7-5-13-30-16-19;26-24(27,28)22-12-20(17-5-3-11-32-14-17)35-36(22)19-9-7-16(8-10-19)13-33-23(37)34-15-18-4-1-2-6-21(18)38-25(29,30)31;1-2-35-12-9-31-14-16(3-6-21(31)33)22(34)27-19-4-5-20(29-28-19)32-18(23(24,25)26)13-17(30-32)15-7-10-36-11-8-15;1-26-35(33,34)17-7-4-14(5-8-17)21(32)29-20-9-6-16(13-28-20)31-19(22(23,24)25)11-18(30-31)15-3-2-10-27-12-15;23-22(24,25)18-10-17(15-2-1-9-26-11-15)29-30(18)16-7-8-19(27-12-16)28-20(31)13-3-5-14(6-4-13)21(32)33;1-3-32-10-9-28-13-14(5-8-19(28)30)20(31)26-17-7-6-15(12-25-17)29-16(21(22,23)24)11-18(27-29)33-4-2/h3-14,16H,2,15,17H2,1H3,(H2,31,32,35);1-12,14H,13,15H2,(H2,33,34,37);3-6,13-15H,2,7-12H2,1H3,(H,27,28,34);2-13,26H,1H3,(H,28,29,32);1-12H,(H,32,33)(H,27,28,31);5-8,11-13H,3-4,9-10H2,1-2H3,(H,25,26,31).
What are the key properties of 1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid?
1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid has a molecular weight of 2958.73 g/mol, XLogP of 25.17, 43 rotatable bonds, 10 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethyl)-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;1-(2-ethoxyethyl)-N-[6-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-6-oxopyridine-3-carboxamide;1-[(2-ethoxyphenyl)methyl]-3-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]urea;4-(methylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[[4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea;4-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]benzoic acid is sourced from PubChem (CID 159638874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).