5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole

C92H82F30N14S7 — CID 158628879

IUPAC5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole
SMILESCC(C)(C)c1sc(-c2cccnc2)nc1C(F)(F)F.CC(C)(C)c1sc(-c2cncc(F)c2)nc1C(F)(F)F.CC(C)C(C)c1sc(-c2cccnc2)nc1C(F)(F)F.CC(C)C(C)c1sc(-c2cncc(F)c2)nc1C(F)(F)F.CC(c1sc(-c2cccnc2)nc1C(F)(F)F)C(F)(F)F.CC(c1sc(-c2cccnc2)nc1C(F)(F)F)C1CC1.CC(c1sc(-c2cncc(F)c2)nc1C(F)(F)F)C(F)(F)F
InChIInChI=1S/C14H14F4N2S.C14H13F3N2S.C14H15F3N2S.C13H12F4N2S.C13H13F3N2S.C12H7F7N2S.C12H8F6N2S/c1-7(2)8(3)11-12(14(16,17)18)20-13(21-11)9-4-10(15)6-19-5-9;1-8(9-4-5-9)11-12(14(15,16)17)19-13(20-11)10-3-2-6-18-7-10;1-8(2)9(3)11-12(14(15,16)17)19-13(20-11)10-5-4-6-18-7-10;1-12(2,3)10-9(13(15,16)17)19-11(20-10)7-4-8(14)6-18-5-7;1-12(2,3)10-9(13(14,15)16)18-11(19-10)8-5-4-6-17-7-8;1-5(11(14,15)16)8-9(12(17,18)19)21-10(22-8)6-2-7(13)4-20-3-6;1-6(11(13,14)15)8-9(12(16,17)18)20-10(21-8)7-3-2-4-19-5-7/h4-8H,1-3H3;2-3,6-9H,4-5H2,1H3;4-9H,1-3H3;4-6H,1-3H3;4-7H,1-3H3;2-5H,1H3;2-6H,1H3
InChIKeyHYYBKZCAQHLQIZ-UHFFFAOYSA-N
MW2178.17 g/mol
LogP33.94
Rot. Bonds15

About 5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole

5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole (PubChem CID 158628879) has the molecular formula C92H82F30N14S7 and a molecular weight of 2178.17 g/mol. Its IUPAC name is 5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole.

Molecular Properties

Compound Name5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole
PubChem CID158628879
Molecular FormulaC92H82F30N14S7
Molecular Weight2178.17 g/mol
Exact Mass2176.44
IUPAC Name5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole
SMILESCC(C)(C)c1sc(-c2cccnc2)nc1C(F)(F)F.CC(C)(C)c1sc(-c2cncc(F)c2)nc1C(F)(F)F.CC(C)C(C)c1sc(-c2cccnc2)nc1C(F)(F)F.CC(C)C(C)c1sc(-c2cncc(F)c2)nc1C(F)(F)F.CC(c1sc(-c2cccnc2)nc1C(F)(F)F)C(F)(F)F.CC(c1sc(-c2cccnc2)nc1C(F)(F)F)C1CC1.CC(c1sc(-c2cncc(F)c2)nc1C(F)(F)F)C(F)(F)F
InChIInChI=1S/C14H14F4N2S.C14H13F3N2S.C14H15F3N2S.C13H12F4N2S.C13H13F3N2S.C12H7F7N2S.C12H8F6N2S/c1-7(2)8(3)11-12(14(16,17)18)20-13(21-11)9-4-10(15)6-19-5-9;1-8(9-4-5-9)11-12(14(15,16)17)19-13(20-11)10-3-2-6-18-7-10;1-8(2)9(3)11-12(14(15,16)17)19-13(20-11)10-5-4-6-18-7-10;1-12(2,3)10-9(13(15,16)17)19-11(20-10)7-4-8(14)6-18-5-7;1-12(2,3)10-9(13(14,15)16)18-11(19-10)8-5-4-6-17-7-8;1-5(11(14,15)16)8-9(12(17,18)19)21-10(22-8)6-2-7(13)4-20-3-6;1-6(11(13,14)15)8-9(12(16,17)18)20-10(21-8)7-3-2-4-19-5-7/h4-8H,1-3H3;2-3,6-9H,4-5H2,1H3;4-9H,1-3H3;4-6H,1-3H3;4-7H,1-3H3;2-5H,1H3;2-6H,1H3
InChIKeyHYYBKZCAQHLQIZ-UHFFFAOYSA-N
XLogP33.94
TPSA180.46 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds15
Heavy Atoms143
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002178.17
LogP ≤ 533.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole 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

5-(1-Cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole
CID 157485855
1,4-Ditert-butyl-5-cyclopropylpyrazole;1,4-ditert-butyl-5-(difluoromethyl)pyrazole;1,4-ditert-butyl-3,5-dimethylpyrazole;1,4-ditert-butyl-5-(2-methylpropyl)pyrazole;1,3-ditert-butyl-5-methylpyrazole;1,4-ditert-butyl-3-methylpyrazole;1,4-ditert-butyl-5-methylpyrazole;2,4-ditert-butyl-3-methylpyridine;1,3-ditert-butyl-2-methylpyrrole;1,4-ditert-butyl-5-propan-2-ylpyrazole;1,3-ditert-butylpyrazole;1,4-ditert-butylpyrazole;2,4-ditert-butylpyridine;1,3-ditert-butylpyrrole;2,5-ditert-butyl-1,3-thiazole;2,5-ditert-butylthiophene;1,4-ditert-butyl-5-(trifluoromethyl)pyrazole;methane
CID 157788230
N-ethyl-4-fluoro-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;N-ethyl-4-fluoro-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-fluoro-N,N-dimethyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-fluoro-2-(5-fluoro-3-pyridinyl)-N,N-dimethyl-1,3-thiazol-5-amine;4-fluoro-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-fluoro-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine
CID 158170046
4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine
CID 158261475
2-Cyclopropyl-6-propan-2-ylpyridine;4-cyclopropyl-2-propan-2-ylpyridine;bis(5-cyclopropyl-2-propan-2-ylpyridine);2-cyclopropyl-5-propan-2-yl-1,3-thiazole;methane;5-methyl-2-propan-2-yl-1,3-benzothiazole;5-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-yl-4,5,6,7-tetrahydro-1,3-benzothiazole;2-methyl-4-propan-2-yl-1,3-thiazole;3-methyl-5-propan-2-yl-1,2-thiazole;tris(5-methyl-2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole);2-propan-2-yl-4-(trifluoromethyl)pyridine;2-propan-2-yl-6-(trifluoromethyl)pyridine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole;bis(5-propan-2-yl-2-(trifluoromethyl)-1,3-thiazole)
CID 158359931
2-Tert-butyl-1,3-thiazole;2-cyclopropyl-5-methyl-1,3-thiazole;5-methyl-2-phenyl-1,3-thiazole;2-methyl-5-propan-2-yl-1,3-thiazole;5-methyl-2-pyridin-2-yl-1,3-thiazole;5-methyl-2-pyridin-3-yl-1,3-thiazole;5-methyl-2-(trifluoromethyl)-1,3-thiazole;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;2-(trifluoromethyl)-1,3-thiazole
CID 158433296
5-tert-butyl-4-ethyl-2-pyridin-3-yl-1,3-thiazole;4,5-diethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4,5-diethyl-2-pyridin-3-yl-1,3-thiazole;4-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-ethyl-2-(5-fluoro-3-pyridinyl)-5-propan-2-yl-1,3-thiazole;4-ethyl-5-propan-2-yl-2-pyridin-3-yl-1,3-thiazole
CID 159176609
5-Tert-butyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole-4-carbonitrile;5-tert-butyl-2-pyridin-3-yl-1,3-thiazole-4-carbonitrile;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole-4-carbonitrile;2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole-4-carbonitrile;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole-4-carbonitrile;2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole-4-carbonitrile
CID 159211017
N,4-diethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;N,4-diethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-ethyl-N,N-dimethyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-ethyl-2-(5-fluoro-3-pyridinyl)-N,N-dimethyl-1,3-thiazol-5-amine;4-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-ethyl-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine
CID 159256551
5-Tert-butyl-4-cyclopropyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-tert-butyl-4-cyclopropyl-2-pyridin-3-yl-1,3-thiazole;4-cyclopropyl-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-cyclopropyl-2-(5-fluoro-3-pyridinyl)-5-propan-2-yl-1,3-thiazole;4-cyclopropyl-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-cyclopropyl-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole
CID 159271315
2-[3-(4-Tert-butyl-1-methylpyridin-1-ium-2-yl)-2-methylphenyl]-3-methyl-1,3-thiazol-3-ium;2-[4,6-difluoro-2-methyl-3-(1-methylpyridin-1-ium-2-yl)phenyl]-3-methyl-1,3-thiazol-3-ium;3-methyl-2-[2-methyl-3-(1-methylpyridin-1-ium-2-yl)phenyl]-1,3-thiazol-3-ium;3-methyl-2-[2-methyl-3-(1-methylpyridin-1-ium-2-yl)-5-(trifluoromethyl)phenyl]-1,3-thiazol-3-ium;3-methyl-2-[2,4,6-trimethyl-3-(1-methylpyridin-1-ium-2-yl)phenyl]-1,3-thiazol-3-ium
CID 159443307
5-Tert-butyl-4-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-ethyl-2-pyridin-3-yl-1,3-thiazole;4-ethyl-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-ethyl-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-ethyl-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-ethyl-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole
CID 159553244

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole?
The IUPAC name of 5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole (CID 158628879) is 5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole.
What is the SMILES notation for 5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole?
The canonical SMILES for 5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole is CC(C)(C)c1sc(-c2cccnc2)nc1C(F)(F)F.CC(C)(C)c1sc(-c2cncc(F)c2)nc1C(F)(F)F.CC(C)C(C)c1sc(-c2cccnc2)nc1C(F)(F)F.CC(C)C(C)c1sc(-c2cncc(F)c2)nc1C(F)(F)F.CC(c1sc(-c2cccnc2)nc1C(F)(F)F)C(F)(F)F.CC(c1sc(-c2cccnc2)nc1C(F)(F)F)C1CC1.CC(c1sc(-c2cncc(F)c2)nc1C(F)(F)F)C(F)(F)F.
What is the InChIKey of 5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole?
The InChIKey is HYYBKZCAQHLQIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F4N2S.C14H13F3N2S.C14H15F3N2S.C13H12F4N2S.C13H13F3N2S.C12H7F7N2S.C12H8F6N2S/c1-7(2)8(3)11-12(14(16,17)18)20-13(21-11)9-4-10(15)6-19-5-9;1-8(9-4-5-9)11-12(14(15,16)17)19-13(20-11)10-3-2-6-18-7-10;1-8(2)9(3)11-12(14(15,16)17)19-13(20-11)10-5-4-6-18-7-10;1-12(2,3)10-9(13(15,16)17)19-11(20-10)7-4-8(14)6-18-5-7;1-12(2,3)10-9(13(14,15)16)18-11(19-10)8-5-4-6-17-7-8;1-5(11(14,15)16)8-9(12(17,18)19)21-10(22-8)6-2-7(13)4-20-3-6;1-6(11(13,14)15)8-9(12(16,17)18)20-10(21-8)7-3-2-4-19-5-7/h4-8H,1-3H3;2-3,6-9H,4-5H2,1H3;4-9H,1-3H3;4-6H,1-3H3;4-7H,1-3H3;2-5H,1H3;2-6H,1H3.
What are the key properties of 5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole?
5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole has a molecular weight of 2178.17 g/mol, XLogP of 33.94, 15 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1,3-thiazole;5-tert-butyl-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;5-(1-cyclopropylethyl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-thiazole;2-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;5-(3-methylbutan-2-yl)-2-pyridin-3-yl-4-(trifluoromethyl)-1,3-thiazole;2-pyridin-3-yl-4-(trifluoromethyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole is sourced from PubChem (CID 158628879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).