1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea

C103H124F5N27O15S5 — CID 159617590

IUPAC1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea
SMILESCC(C)c1cc(F)cc(-c2ccccc2)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.CC(C)c1cc(F)cc(-c2cccnc2)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.CC(C)c1cc(F)cc(-c2ccnn2C)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.CC(C)c1cc(F)cc(-c2cncn2C)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.CC(C)c1cc(F)cc(-c2cnn(C)c2)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1
InChIInChI=1S/C22H25FN4O3S.C21H24FN5O3S.3C20H25FN6O3S/c1-14(2)18-12-17(23)13-19(16-8-6-5-7-9-16)21(18)24-22(28)26-31(29,30)20-10-11-27(25-20)15(3)4;1-13(2)17-10-16(22)11-18(15-6-5-8-23-12-15)20(17)24-21(28)26-31(29,30)19-7-9-27(25-19)14(3)4;1-12(2)15-10-14(21)11-16(17-6-8-22-26(17)5)19(15)23-20(28)25-31(29,30)18-7-9-27(24-18)13(3)4;1-12(2)16-8-15(21)9-17(14-10-22-26(5)11-14)19(16)23-20(28)25-31(29,30)18-6-7-27(24-18)13(3)4;1-12(2)15-8-14(21)9-16(17-10-22-11-26(17)5)19(15)23-20(28)25-31(29,30)18-6-7-27(24-18)13(3)4/h5-15H,1-4H3,(H2,24,26,28);5-14H,1-4H3,(H2,24,26,28);3*6-13H,1-5H3,(H2,23,25,28)
InChIKeyMNMARKDWKNYTTQ-UHFFFAOYSA-N
MW2235.62 g/mol
LogP20.11
Rot. Bonds30

About 1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea

1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea (PubChem CID 159617590) has the molecular formula C103H124F5N27O15S5 and a molecular weight of 2235.62 g/mol. Its IUPAC name is 1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea.

Molecular Properties

Compound Name1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea
PubChem CID159617590
Molecular FormulaC103H124F5N27O15S5
Molecular Weight2235.62 g/mol
Exact Mass2233.83
IUPAC Name1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea
SMILESCC(C)c1cc(F)cc(-c2ccccc2)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.CC(C)c1cc(F)cc(-c2cccnc2)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.CC(C)c1cc(F)cc(-c2ccnn2C)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.CC(C)c1cc(F)cc(-c2cncn2C)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.CC(C)c1cc(F)cc(-c2cnn(C)c2)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1
InChIInChI=1S/C22H25FN4O3S.C21H24FN5O3S.3C20H25FN6O3S/c1-14(2)18-12-17(23)13-19(16-8-6-5-7-9-16)21(18)24-22(28)26-31(29,30)20-10-11-27(25-20)15(3)4;1-13(2)17-10-16(22)11-18(15-6-5-8-23-12-15)20(17)24-21(28)26-31(29,30)19-7-9-27(25-19)14(3)4;1-12(2)15-10-14(21)11-16(17-6-8-22-26(17)5)19(15)23-20(28)25-31(29,30)18-7-9-27(24-18)13(3)4;1-12(2)16-8-15(21)9-17(14-10-22-26(5)11-14)19(16)23-20(28)25-31(29,30)18-6-7-27(24-18)13(3)4;1-12(2)15-8-14(21)9-16(17-10-22-11-26(17)5)19(15)23-20(28)25-31(29,30)18-6-7-27(24-18)13(3)4/h5-15H,1-4H3,(H2,24,26,28);5-14H,1-4H3,(H2,24,26,28);3*6-13H,1-5H3,(H2,23,25,28)
InChIKeyMNMARKDWKNYTTQ-UHFFFAOYSA-N
XLogP20.11
TPSA531.80 Ų
H-Bond Donors10
H-Bond Acceptors32
Rotatable Bonds30
Heavy Atoms155
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002235.62
LogP ≤ 520.11
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1032

Analyze 1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea with MolForge

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Launch Full Analysis

Related Compounds

1-[4-Fluoro-2-[3-[3-[5-fluoro-3-(2-methyl-4-pyridinyl)-2-[(1-propan-2-ylpyrazol-3-yl)sulfonylcarbamoylamino]phenyl]butyl]-1-methylpyrazol-5-yl]-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea
CID 137509745
1-[4-Fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea
CID 137509926
1-[5-[(Dimethylamino)methyl]-1-methylpyrazol-3-yl]sulfonyl-3-[2-[4-[5-[2-[[5-[(dimethylamino)methyl]-1-methylpyrazol-3-yl]sulfonylcarbamoylamino]-5-fluoro-3-propan-2-ylphenyl]-1-methylpyrazol-3-yl]butan-2-yl]-4-fluoro-6-pyridin-3-ylphenyl]urea
CID 156345367
(3S,4R)-3-ethyl-4-[5-(4-methylphenyl)sulfonyl-1,5,7,10,11-pentazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3R,4S)-3-ethyl-4-[5-(4-methylphenyl)sulfonyl-1,5,7,10,11-pentazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;3-ethyl-4-[5-(4-methylphenyl)sulfonyl-1,5,7,10,11-pentazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide
CID 157110987
4-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide;4-[5-(2-methyl-5-pyridin-3-ylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide;4-[5-(2-methyl-5-pyrimidin-2-ylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide;4-[5-[2-methyl-5-(2H-pyrrol-4-yl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide
CID 157933484
1-[2-(2-Cyano-4-pyridinyl)-4-fluoro-6-propan-2-ylphenyl]-3-[5-[(dimethylamino)methyl]-1-ethylpyrazol-3-yl]sulfonylurea;1-[2-(2-cyano-4-pyridinyl)-4-fluoro-6-propan-2-ylphenyl]-3-[5-[(dimethylamino)methyl]-1-methylpyrazol-3-yl]sulfonylurea;1-[5-[(dimethylamino)methyl]-1-propan-2-ylpyrazol-3-yl]sulfonyl-3-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)urea;1-[5-[(dimethylamino)methyl]-1-propan-2-ylpyrazol-3-yl]sulfonyl-3-[4-fluoro-2-propan-2-yl-6-[2-(trifluoromethyl)-4-pyridinyl]phenyl]urea;1-[2-[2-(dimethylamino)-4-pyridinyl]-4-fluoro-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea
CID 158938543
1-[6-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]sulfonyl-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine;N,N-dimethyl-4-[3-[6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridin-1-yl]sulfonylimidazo[1,2-a]pyridin-6-yl]aniline;1-[6-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]sulfonyl-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-[6-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]sulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-[6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]sulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-[6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]sulfonylpyrazolo[4,5-b]pyridine;hydrochloride
CID 159183249
1-[4-fluoro-2,6-di(propan-2-yl)phenyl]-3-[1-[(2R)-2-hydroxypropyl]pyrazol-3-yl]sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-[1-[(2S)-2-hydroxypropyl]imidazol-4-yl]sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-[1-[(2R)-2-hydroxypropyl]imidazol-4-yl]sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-[1-(oxan-4-yl)pyrazol-3-yl]sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-[1-(3,3,3-trifluoro-2-hydroxypropyl)pyrazol-3-yl]sulfonylurea
CID 159930092
1-[2-(2-Cyano-4-pyridinyl)-4-fluoro-6-propan-2-ylphenyl]-3-[5-[(dimethylamino)methyl]-1-methylpyrazol-3-yl]sulfonylurea;1-[5-[(dimethylamino)methyl]-1-methylpyrazol-3-yl]sulfonyl-3-[2-(2,5-dimethylpyrazol-3-yl)-4-fluoro-6-propan-2-ylphenyl]urea;1-[5-[(dimethylamino)methyl]-1-methylpyrazol-3-yl]sulfonyl-3-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)urea;1-[5-[(dimethylamino)methyl]-1-propan-2-ylpyrazol-3-yl]sulfonyl-3-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)urea;1-[5-[(dimethylamino)methyl]-1-propan-2-ylpyrazol-3-yl]sulfonyl-3-(4-fluoro-2-propan-2-yl-6-pyrimidin-5-ylphenyl)urea;1-[4-fluoro-2-propan-2-yl-6-[2-(trifluoromethyl)-4-pyridinyl]phenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea
CID 160050088
3-(ethylamino-methylidene-oxo-lambda6-sulfanyl)-N-methylaniline;bis(N-ethyl-3-(methylamino)benzenesulfonamide);N-ethyl-N-methyl-3-(methylamino)benzenesulfonamide;3-(1H-imidazol-5-yl)-N-methylaniline;1-[3-(methylamino)phenyl]imidazolidin-2-one;N-methyl-3-[1-(methylamino)ethenyl]-5-(trifluoromethyl)aniline;1-methyl-3-[3-(methylamino)phenyl]imidazolidin-2-one;N-methyl-3-(1-methylpyrazol-3-yl)aniline;N-methyl-3-(2-methyl-1,2,4-triazol-3-yl)aniline;N-methyl-3-piperidin-1-ylaniline
CID 160443534
4-(dimethylamino)-N-(1-propan-2-ylpyrazol-3-yl)sulfonylpyridin-1-ium-1-carboximidate;4-fluoro-2-propan-2-yl-6-[2-(trifluoromethyl)-4-pyridinyl]aniline;1-[4-fluoro-2-propan-2-yl-6-[2-(trifluoromethyl)-4-pyridinyl]phenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea
CID 161038375
N,N-dimethyl-4-[3-[6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridin-1-yl]sulfonylimidazo[1,2-a]pyridin-6-yl]aniline;1-[6-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]sulfonyl-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine;1-[6-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]sulfonyl-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-[6-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]sulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-[6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]sulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-[6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]sulfonylpyrazolo[4,5-b]pyridine;hydrochloride
CID 162210168

Frequently Asked Questions

What is the IUPAC name of 1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea?
The IUPAC name of 1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea (CID 159617590) is 1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea.
What is the SMILES notation for 1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea?
The canonical SMILES for 1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea is CC(C)c1cc(F)cc(-c2ccccc2)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.CC(C)c1cc(F)cc(-c2cccnc2)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.CC(C)c1cc(F)cc(-c2ccnn2C)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.CC(C)c1cc(F)cc(-c2cncn2C)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.CC(C)c1cc(F)cc(-c2cnn(C)c2)c1NC(=O)NS(=O)(=O)c1ccn(C(C)C)n1.
What is the InChIKey of 1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea?
The InChIKey is MNMARKDWKNYTTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25FN4O3S.C21H24FN5O3S.3C20H25FN6O3S/c1-14(2)18-12-17(23)13-19(16-8-6-5-7-9-16)21(18)24-22(28)26-31(29,30)20-10-11-27(25-20)15(3)4;1-13(2)17-10-16(22)11-18(15-6-5-8-23-12-15)20(17)24-21(28)26-31(29,30)19-7-9-27(25-19)14(3)4;1-12(2)15-10-14(21)11-16(17-6-8-22-26(17)5)19(15)23-20(28)25-31(29,30)18-7-9-27(24-18)13(3)4;1-12(2)16-8-15(21)9-17(14-10-22-26(5)11-14)19(16)23-20(28)25-31(29,30)18-6-7-27(24-18)13(3)4;1-12(2)15-8-14(21)9-16(17-10-22-11-26(17)5)19(15)23-20(28)25-31(29,30)18-6-7-27(24-18)13(3)4/h5-15H,1-4H3,(H2,24,26,28);5-14H,1-4H3,(H2,24,26,28);3*6-13H,1-5H3,(H2,23,25,28).
What are the key properties of 1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea?
1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea has a molecular weight of 2235.62 g/mol, XLogP of 20.11, 30 rotatable bonds, 10 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-fluoro-2-(3-methylimidazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(1-methylpyrazol-4-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[4-fluoro-2-(2-methylpyrazol-3-yl)-6-propan-2-ylphenyl]-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-phenyl-6-propan-2-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4-fluoro-2-propan-2-yl-6-pyridin-3-ylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea is sourced from PubChem (CID 159617590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).