1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole

C152H151Cl11F5N23O6S2 — CID 163821284

IUPAC1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole
SMILESCC(C)c1c(-n2cc(C(=O)O)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(S(C)(=O)=O)cn2)ccc(Cl)c1F.CC(C)c1cc(Cl)ccc1-c1ccc2ccncc2c1.CC(C)c1cc(Cl)ccc1-c1cccc2cnccc12.CC(C)c1cc(Cl)ccc1-c1cccnn1.CC(C)c1cc(Cl)ccc1-c1ccnnc1.CC(C)c1cc(Cl)ccc1-c1cncnc1.CC(C)c1cc(Cl)ccc1-c1cnn(C(F)(F)F)c1.CC(C)c1cc(Cl)ccc1-n1cc(S(C)(=O)=O)cn1.CC(C)c1cc(Cl)ccc1Nc1cnccn1.CC(C)c1cc(Cl)ccc1Nc1ncccn1
InChIInChI=1S/2C18H16ClN.C13H12ClF3N2.C13H14ClFN2O2S.2C13H14ClN3.C13H15ClN2O2S.3C13H13ClN2.C12H11ClFN3O2/c1-12(2)18-10-16(19)5-6-17(18)14-4-3-13-7-8-20-11-15(13)9-14;1-12(2)18-10-14(19)6-7-17(18)16-5-3-4-13-11-20-9-8-15(13)16;1-8(2)12-5-10(14)3-4-11(12)9-6-18-19(7-9)13(15,16)17;1-8(2)12-11(5-4-10(14)13(12)15)17-7-9(6-16-17)20(3,18)19;1-9(2)11-8-10(14)4-5-12(11)17-13-15-6-3-7-16-13;1-9(2)11-7-10(14)3-4-12(11)17-13-8-15-5-6-16-13;1-9(2)12-6-10(14)4-5-13(12)16-8-11(7-15-16)19(3,17)18;1-9(2)13-5-11(14)3-4-12(13)10-6-15-8-16-7-10;1-9(2)13-7-11(14)3-4-12(13)10-5-6-15-16-8-10;1-9(2)12-8-10(14)5-6-11(12)13-4-3-7-15-16-13;1-6(2)10-9(4-3-7(13)11(10)14)17-5-8(12(18)19)15-16-17/h2*3-12H,1-2H3;3-8H,1-2H3;4-8H,1-3H3;3-9H,1-2H3,(H,15,16,17);3-9H,1-2H3,(H,16,17);4-9H,1-3H3;3*3-9H,1-2H3;3-6H,1-2H3,(H,18,19)
InChIKeyNVPXLNUBCBVTNX-UHFFFAOYSA-N
MW2945.14 g/mol
LogP45.04
Rot. Bonds27

About 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole

1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole (PubChem CID 163821284) has the molecular formula C152H151Cl11F5N23O6S2 and a molecular weight of 2945.14 g/mol. Its IUPAC name is 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole.

Molecular Properties

Compound Name1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole
PubChem CID163821284
Molecular FormulaC152H151Cl11F5N23O6S2
Molecular Weight2945.14 g/mol
Exact Mass2937.82
IUPAC Name1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole
SMILESCC(C)c1c(-n2cc(C(=O)O)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(S(C)(=O)=O)cn2)ccc(Cl)c1F.CC(C)c1cc(Cl)ccc1-c1ccc2ccncc2c1.CC(C)c1cc(Cl)ccc1-c1cccc2cnccc12.CC(C)c1cc(Cl)ccc1-c1cccnn1.CC(C)c1cc(Cl)ccc1-c1ccnnc1.CC(C)c1cc(Cl)ccc1-c1cncnc1.CC(C)c1cc(Cl)ccc1-c1cnn(C(F)(F)F)c1.CC(C)c1cc(Cl)ccc1-n1cc(S(C)(=O)=O)cn1.CC(C)c1cc(Cl)ccc1Nc1cnccn1.CC(C)c1cc(Cl)ccc1Nc1ncccn1
InChIInChI=1S/2C18H16ClN.C13H12ClF3N2.C13H14ClFN2O2S.2C13H14ClN3.C13H15ClN2O2S.3C13H13ClN2.C12H11ClFN3O2/c1-12(2)18-10-16(19)5-6-17(18)14-4-3-13-7-8-20-11-15(13)9-14;1-12(2)18-10-14(19)6-7-17(18)16-5-3-4-13-11-20-9-8-15(13)16;1-8(2)12-5-10(14)3-4-11(12)9-6-18-19(7-9)13(15,16)17;1-8(2)12-11(5-4-10(14)13(12)15)17-7-9(6-16-17)20(3,18)19;1-9(2)11-8-10(14)4-5-12(11)17-13-15-6-3-7-16-13;1-9(2)11-7-10(14)3-4-12(11)17-13-8-15-5-6-16-13;1-9(2)12-6-10(14)4-5-13(12)16-8-11(7-15-16)19(3,17)18;1-9(2)13-5-11(14)3-4-12(13)10-6-15-8-16-7-10;1-9(2)13-7-11(14)3-4-12(13)10-5-6-15-16-8-10;1-9(2)12-8-10(14)5-6-11(12)13-4-3-7-15-16-13;1-6(2)10-9(4-3-7(13)11(10)14)17-5-8(12(18)19)15-16-17/h2*3-12H,1-2H3;3-8H,1-2H3;4-8H,1-3H3;3-9H,1-2H3,(H,15,16,17);3-9H,1-2H3,(H,16,17);4-9H,1-3H3;3*3-9H,1-2H3;3-6H,1-2H3,(H,18,19)
InChIKeyNVPXLNUBCBVTNX-UHFFFAOYSA-N
XLogP45.04
TPSA368.49 Ų
H-Bond Donors3
H-Bond Acceptors28
Rotatable Bonds27
Heavy Atoms199
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002945.14
LogP ≤ 545.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1028

Analyze 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole with MolForge

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Related Compounds

Bis(1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole);1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-methyltriazole;1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethyl 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylate;ethyl 1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carboxylate
CID 158568171
1-(4-Chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-chloro-1-methyl-7-propan-2-ylindole;4-chloro-1-(3-methylsulfonylcyclopenta-2,4-dien-1-yl)-2-propan-2-ylbenzene;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonyltriazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methyltriazole;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;3-(4-chloro-2-propan-2-ylphenyl)pyridine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethyl 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylate;ethyl 1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylate
CID 159195225
1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;2-(4-chloro-2-propan-2-ylphenyl)pyridine;3-(4-chloro-2-propan-2-ylphenyl)pyridine;4-(4-chloro-2-propan-2-ylphenyl)pyridine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole
CID 159239293
1-(4-Chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonyltriazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;3-(4-chloro-2-propan-2-ylphenyl)pyridine;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethyl 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylate;ethyl 1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylate
CID 159447976
1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;3-(4-chloro-2-propan-2-ylphenyl)pyridine;4-(4-chloro-2-propan-2-ylphenyl)pyridine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethyl 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylate;ethyl 1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylate
CID 160601212
1-(4-Chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonyltriazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methyltriazole;bis(3-(4-chloro-2-propan-2-ylphenyl)pyridazine);3-(4-chloro-2-propan-2-ylphenyl)pyridine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethyl 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylate;ethyl 1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylate
CID 160722576
1-(4-Chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonyltriazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methyltriazole;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethyl 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylate;ethyl 1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylate
CID 160907242
1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethyl 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylate;ethyl 1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylate
CID 161090815
1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;tetrakis(4-chloro-1-phenyl-2-propan-2-ylbenzene);5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;2-(4-chloro-2-propan-2-ylphenyl)pyridine;3-(4-chloro-2-propan-2-ylphenyl)pyridine;4-(4-chloro-2-propan-2-ylphenyl)pyridine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane;methanesulfonamide
CID 161696379
1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonyltriazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethyl 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylate;ethyl 1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylate
CID 161701911
1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;3-(4-chloro-2-propan-2-ylphenyl)pyridine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine
CID 157366020
1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonyltriazole;5-chloro-1-methyl-7-propan-2-ylindole;5-chloro-7-propan-2-yl-1H-indole;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonyltriazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methyltriazole;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;3-(4-chloro-2-propan-2-ylphenyl)pyridine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;ethyl 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylate;ethyl 1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carboxylate
CID 163793084

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole?
The IUPAC name of 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole (CID 163821284) is 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole.
What is the SMILES notation for 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole?
The canonical SMILES for 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole is CC(C)c1c(-n2cc(C(=O)O)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(S(C)(=O)=O)cn2)ccc(Cl)c1F.CC(C)c1cc(Cl)ccc1-c1ccc2ccncc2c1.CC(C)c1cc(Cl)ccc1-c1cccc2cnccc12.CC(C)c1cc(Cl)ccc1-c1cccnn1.CC(C)c1cc(Cl)ccc1-c1ccnnc1.CC(C)c1cc(Cl)ccc1-c1cncnc1.CC(C)c1cc(Cl)ccc1-c1cnn(C(F)(F)F)c1.CC(C)c1cc(Cl)ccc1-n1cc(S(C)(=O)=O)cn1.CC(C)c1cc(Cl)ccc1Nc1cnccn1.CC(C)c1cc(Cl)ccc1Nc1ncccn1.
What is the InChIKey of 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole?
The InChIKey is NVPXLNUBCBVTNX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H16ClN.C13H12ClF3N2.C13H14ClFN2O2S.2C13H14ClN3.C13H15ClN2O2S.3C13H13ClN2.C12H11ClFN3O2/c1-12(2)18-10-16(19)5-6-17(18)14-4-3-13-7-8-20-11-15(13)9-14;1-12(2)18-10-14(19)6-7-17(18)16-5-3-4-13-11-20-9-8-15(13)16;1-8(2)12-5-10(14)3-4-11(12)9-6-18-19(7-9)13(15,16)17;1-8(2)12-11(5-4-10(14)13(12)15)17-7-9(6-16-17)20(3,18)19;1-9(2)11-8-10(14)4-5-12(11)17-13-15-6-3-7-16-13;1-9(2)11-7-10(14)3-4-12(11)17-13-8-15-5-6-16-13;1-9(2)12-6-10(14)4-5-13(12)16-8-11(7-15-16)19(3,17)18;1-9(2)13-5-11(14)3-4-12(13)10-6-15-8-16-7-10;1-9(2)13-7-11(14)3-4-12(13)10-5-6-15-16-8-10;1-9(2)12-8-10(14)5-6-11(12)13-4-3-7-15-16-13;1-6(2)10-9(4-3-7(13)11(10)14)17-5-8(12(18)19)15-16-17/h2*3-12H,1-2H3;3-8H,1-2H3;4-8H,1-3H3;3-9H,1-2H3,(H,15,16,17);3-9H,1-2H3,(H,16,17);4-9H,1-3H3;3*3-9H,1-2H3;3-6H,1-2H3,(H,18,19).
What are the key properties of 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole?
1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole has a molecular weight of 2945.14 g/mol, XLogP of 45.04, 27 rotatable bonds, 3 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carboxylic acid;5-(4-chloro-2-propan-2-ylphenyl)isoquinoline;7-(4-chloro-2-propan-2-ylphenyl)isoquinoline;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;N-(4-chloro-2-propan-2-ylphenyl)pyrazin-2-amine;3-(4-chloro-2-propan-2-ylphenyl)pyridazine;4-(4-chloro-2-propan-2-ylphenyl)pyridazine;N-(4-chloro-2-propan-2-ylphenyl)pyrimidin-2-amine;5-(4-chloro-2-propan-2-ylphenyl)pyrimidine;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole is sourced from PubChem (CID 163821284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).