4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole

C183H187Cl17F16N40O6 — CID 160732017

IUPAC4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
SMILESCC(C)c1c(-n2cc(C(=O)O)cn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(C(F)F)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(CF)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(Cl)cn2)ccc(Cl)c1F.CC(C)c1cc(Cl)ccc1-c1cnn(C(F)F)c1.CC(C)c1cc(Cl)ccc1-n1cc(C(=O)O)cn1.CC(C)c1cc(Cl)ccc1-n1cc(C(F)(F)F)cn1.CC(C)c1cc(Cl)ccc1-n1cc(C(F)F)nn1.CC(C)c1cc(Cl)ccc1-n1cc(C(N)=O)nn1.CC(C)c1cc(Cl)ccc1-n1cc(CF)nn1.CC(C)c1cc(Cl)ccc1-n1cc(Cl)cn1.CC(C)c1cc(Cl)ccc1-n1cc(O)nn1.Cc1cn(-c2ccc(Cl)c(F)c2C(C)C)nn1.Cc1cn(-c2ccc(Cl)cc2C(C)C)nn1.Cc1cn(-c2ccc(Cl)cc2C(C)C)nn1
InChIInChI=1S/C13H12ClF3N2.C13H13ClF2N2.C13H12ClFN2O2.C13H13ClN2O2.C12H11Cl2FN2.C12H12Cl2N2.C12H11ClF3N3.2C12H12ClF2N3.2C12H13ClFN3.C12H13ClN4O.2C12H14ClN3.C11H12ClN3O/c1-8(2)11-5-10(14)3-4-12(11)19-7-9(6-18-19)13(15,16)17;1-8(2)12-5-10(14)3-4-11(12)9-6-17-18(7-9)13(15)16;1-7(2)11-10(4-3-9(14)12(11)15)17-6-8(5-16-17)13(18)19;1-8(2)11-5-10(14)3-4-12(11)16-7-9(6-15-16)13(17)18;1-7(2)11-10(4-3-9(14)12(11)15)17-6-8(13)5-16-17;1-8(2)11-5-9(13)3-4-12(11)16-7-10(14)6-15-16;1-6(2)10-9(4-3-7(13)11(10)14)19-5-8(12(15)16)17-18-19;1-7(2)11-10(4-3-9(13)12(11)15)18-6-8(5-14)16-17-18;1-7(2)9-5-8(13)3-4-11(9)18-6-10(12(14)15)16-17-18;1-7(2)11-10(5-4-9(13)12(11)14)17-6-8(3)15-16-17;1-8(2)11-5-9(13)3-4-12(11)17-7-10(6-14)15-16-17;1-7(2)9-5-8(13)3-4-11(9)17-6-10(12(14)18)15-16-17;2*1-8(2)11-6-10(13)4-5-12(11)16-7-9(3)14-15-16;1-7(2)9-5-8(12)3-4-10(9)15-6-11(16)13-14-15/h3-8H,1-2H3;3-8,13H,1-2H3;3-7H,1-2H3,(H,18,19);3-8H,1-2H3,(H,17,18);3-7H,1-2H3;3-8H,1-2H3;3-6,12H,1-2H3;3-4,6-7H,5H2,1-2H3;3-7,12H,1-2H3;4-7H,1-3H3;3-5,7-8H,6H2,1-2H3;3-7H,1-2H3,(H2,14,18);2*4-8H,1-3H3;3-7,16H,1-2H3
InChIKeyRULSFNKSJKQEOB-UHFFFAOYSA-N
MW3949.45 g/mol
LogP55.33
Rot. Bonds38

About 4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole

4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole (PubChem CID 160732017) has the molecular formula C183H187Cl17F16N40O6 and a molecular weight of 3949.45 g/mol. Its IUPAC name is 4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole.

Molecular Properties

Compound Name4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
PubChem CID160732017
Molecular FormulaC183H187Cl17F16N40O6
Molecular Weight3949.45 g/mol
Exact Mass3939.00
IUPAC Name4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
SMILESCC(C)c1c(-n2cc(C(=O)O)cn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(C(F)F)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(CF)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(Cl)cn2)ccc(Cl)c1F.CC(C)c1cc(Cl)ccc1-c1cnn(C(F)F)c1.CC(C)c1cc(Cl)ccc1-n1cc(C(=O)O)cn1.CC(C)c1cc(Cl)ccc1-n1cc(C(F)(F)F)cn1.CC(C)c1cc(Cl)ccc1-n1cc(C(F)F)nn1.CC(C)c1cc(Cl)ccc1-n1cc(C(N)=O)nn1.CC(C)c1cc(Cl)ccc1-n1cc(CF)nn1.CC(C)c1cc(Cl)ccc1-n1cc(Cl)cn1.CC(C)c1cc(Cl)ccc1-n1cc(O)nn1.Cc1cn(-c2ccc(Cl)c(F)c2C(C)C)nn1.Cc1cn(-c2ccc(Cl)cc2C(C)C)nn1.Cc1cn(-c2ccc(Cl)cc2C(C)C)nn1
InChIInChI=1S/C13H12ClF3N2.C13H13ClF2N2.C13H12ClFN2O2.C13H13ClN2O2.C12H11Cl2FN2.C12H12Cl2N2.C12H11ClF3N3.2C12H12ClF2N3.2C12H13ClFN3.C12H13ClN4O.2C12H14ClN3.C11H12ClN3O/c1-8(2)11-5-10(14)3-4-12(11)19-7-9(6-18-19)13(15,16)17;1-8(2)12-5-10(14)3-4-11(12)9-6-17-18(7-9)13(15)16;1-7(2)11-10(4-3-9(14)12(11)15)17-6-8(5-16-17)13(18)19;1-8(2)11-5-10(14)3-4-12(11)16-7-9(6-15-16)13(17)18;1-7(2)11-10(4-3-9(14)12(11)15)17-6-8(13)5-16-17;1-8(2)11-5-9(13)3-4-12(11)16-7-10(14)6-15-16;1-6(2)10-9(4-3-7(13)11(10)14)19-5-8(12(15)16)17-18-19;1-7(2)11-10(4-3-9(13)12(11)15)18-6-8(5-14)16-17-18;1-7(2)9-5-8(13)3-4-11(9)18-6-10(12(14)15)16-17-18;1-7(2)11-10(5-4-9(13)12(11)14)17-6-8(3)15-16-17;1-8(2)11-5-9(13)3-4-12(11)17-7-10(6-14)15-16-17;1-7(2)9-5-8(13)3-4-11(9)17-6-10(12(14)18)15-16-17;2*1-8(2)11-6-10(13)4-5-12(11)16-7-9(3)14-15-16;1-7(2)9-5-8(12)3-4-10(9)15-6-11(16)13-14-15/h3-8H,1-2H3;3-8,13H,1-2H3;3-7H,1-2H3,(H,18,19);3-8H,1-2H3,(H,17,18);3-7H,1-2H3;3-8H,1-2H3;3-6,12H,1-2H3;3-4,6-7H,5H2,1-2H3;3-7,12H,1-2H3;4-7H,1-3H3;3-5,7-8H,6H2,1-2H3;3-7H,1-2H3,(H2,14,18);2*4-8H,1-3H3;3-7,16H,1-2H3
InChIKeyRULSFNKSJKQEOB-UHFFFAOYSA-N
XLogP55.33
TPSA521.23 Ų
H-Bond Donors4
H-Bond Acceptors43
Rotatable Bonds38
Heavy Atoms262
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003949.45
LogP ≤ 555.33
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1043

Analyze 4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole with MolForge

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Related Compounds

1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)-4H-pyrazol-1-ium;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 157149446
4-Chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)imidazole;4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)imidazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylpyrazole;bis(1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid);1-(4-chloro-2-propan-2-ylphenyl)-4-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 158109289
1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole);4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)-4H-pyrazol-1-ium;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 158395231
4-Chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)imidazole;4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)imidazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methylpyrazole);1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;methane
CID 158723604
4-Bromo-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;4-bromo-1-(4-chloro-2-propan-2-ylphenyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole);4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)-4-phenyltriazole;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 159092208
4-Chloro-1-(4-chloro-2-propan-2-ylphenyl)imidazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-chloro-2-fluoro-3-propan-2-ylbenzene;1-(4-chloro-2-propan-2-ylphenyl)-4-cyclopropyltriazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)-4-methylimidazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methylpyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole
CID 159140486
4-Chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxamide;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 160436339
4-Chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)imidazole;4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-cyclopropyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)imidazole-4-carboxylic acid;bis(1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylpyrazole);bis(1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-1,2,4-triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole
CID 161163339
4-Chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methylpyrazole;tris(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 161819653
4-Chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)imidazole;4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)imidazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)-4-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 161854828
4-Chloro-1-(4-chloro-2-propan-2-ylphenyl)imidazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-cyclopropyltriazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)-4-methylpyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole
CID 162172082
4-Chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;bis(1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole);bis(1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole);tris(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol
CID 161034023

Frequently Asked Questions

What is the IUPAC name of 4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole?
The IUPAC name of 4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole (CID 160732017) is 4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole.
What is the SMILES notation for 4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole?
The canonical SMILES for 4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole is CC(C)c1c(-n2cc(C(=O)O)cn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(C(F)F)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(CF)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(Cl)cn2)ccc(Cl)c1F.CC(C)c1cc(Cl)ccc1-c1cnn(C(F)F)c1.CC(C)c1cc(Cl)ccc1-n1cc(C(=O)O)cn1.CC(C)c1cc(Cl)ccc1-n1cc(C(F)(F)F)cn1.CC(C)c1cc(Cl)ccc1-n1cc(C(F)F)nn1.CC(C)c1cc(Cl)ccc1-n1cc(C(N)=O)nn1.CC(C)c1cc(Cl)ccc1-n1cc(CF)nn1.CC(C)c1cc(Cl)ccc1-n1cc(Cl)cn1.CC(C)c1cc(Cl)ccc1-n1cc(O)nn1.Cc1cn(-c2ccc(Cl)c(F)c2C(C)C)nn1.Cc1cn(-c2ccc(Cl)cc2C(C)C)nn1.Cc1cn(-c2ccc(Cl)cc2C(C)C)nn1.
What is the InChIKey of 4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole?
The InChIKey is RULSFNKSJKQEOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClF3N2.C13H13ClF2N2.C13H12ClFN2O2.C13H13ClN2O2.C12H11Cl2FN2.C12H12Cl2N2.C12H11ClF3N3.2C12H12ClF2N3.2C12H13ClFN3.C12H13ClN4O.2C12H14ClN3.C11H12ClN3O/c1-8(2)11-5-10(14)3-4-12(11)19-7-9(6-18-19)13(15,16)17;1-8(2)12-5-10(14)3-4-11(12)9-6-17-18(7-9)13(15)16;1-7(2)11-10(4-3-9(14)12(11)15)17-6-8(5-16-17)13(18)19;1-8(2)11-5-10(14)3-4-12(11)16-7-9(6-15-16)13(17)18;1-7(2)11-10(4-3-9(14)12(11)15)17-6-8(13)5-16-17;1-8(2)11-5-9(13)3-4-12(11)16-7-10(14)6-15-16;1-6(2)10-9(4-3-7(13)11(10)14)19-5-8(12(15)16)17-18-19;1-7(2)11-10(4-3-9(13)12(11)15)18-6-8(5-14)16-17-18;1-7(2)9-5-8(13)3-4-11(9)18-6-10(12(14)15)16-17-18;1-7(2)11-10(5-4-9(13)12(11)14)17-6-8(3)15-16-17;1-8(2)11-5-9(13)3-4-12(11)17-7-10(6-14)15-16-17;1-7(2)9-5-8(13)3-4-11(9)17-6-10(12(14)18)15-16-17;2*1-8(2)11-6-10(13)4-5-12(11)16-7-9(3)14-15-16;1-7(2)9-5-8(12)3-4-10(9)15-6-11(16)13-14-15/h3-8H,1-2H3;3-8,13H,1-2H3;3-7H,1-2H3,(H,18,19);3-8H,1-2H3,(H,17,18);3-7H,1-2H3;3-8H,1-2H3;3-6,12H,1-2H3;3-4,6-7H,5H2,1-2H3;3-7,12H,1-2H3;4-7H,1-3H3;3-5,7-8H,6H2,1-2H3;3-7H,1-2H3,(H2,14,18);2*4-8H,1-3H3;3-7,16H,1-2H3.
What are the key properties of 4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole?
4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole has a molecular weight of 3949.45 g/mol, XLogP of 55.33, 38 rotatable bonds, 4 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(fluoromethyl)triazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxamide;1-(4-chloro-2-propan-2-ylphenyl)triazol-4-ol;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole is sourced from PubChem (CID 160732017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).