5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine

C160H186F8N22S7 — CID 159268158

IUPAC5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine
SMILESC.C=C1Cc2ccc(C(C)C)cc2S1.CC(C)c1cc(F)c2ncsc2c1.CC(C)c1cc2ccnn2cc1F.CC(C)c1cc2scnc2cc1F.CC(C)c1ccc2ncsc2c1.CC(C)c1ccn2ncc(F)c2c1.CC(C)c1ccn2nccc2c1.CC(C)c1ccn2nccc2c1F.Cc1cc2c(F)c(C(C)C)ccn2n1.Cc1cn2nccc2cc1C(C)C.Cc1cnn2ccc(C(C)C)cc12.Cc1nc2cc(F)c(C(C)C)cc2s1.Cc1nc2ccc(C(C)C)cc2s1.Cc1nc2ccc(C(C)C)cc2s1.Cc1nn2ccc(C(C)C)cc2c1F
InChIInChI=1S/C12H14S.2C11H13FN2.C11H12FNS.2C11H14N2.2C11H13NS.3C10H11FN2.2C10H10FNS.C10H12N2.C10H11NS.CH4/c1-8(2)10-4-5-11-6-9(3)13-12(11)7-10;1-7(2)9-4-5-14-10(6-9)11(12)8(3)13-14;1-7(2)9-4-5-14-10(11(9)12)6-8(3)13-14;1-6(2)8-4-11-10(5-9(8)12)13-7(3)14-11;1-8(2)11-6-10-4-5-12-13(10)7-9(11)3;1-8(2)10-4-5-13-11(6-10)9(3)7-12-13;2*1-7(2)9-4-5-10-11(6-9)13-8(3)12-10;1-7(2)8-4-6-13-9(10(8)11)3-5-12-13;1-7(2)9-5-8-3-4-12-13(8)6-10(9)11;1-7(2)8-3-4-13-10(5-8)9(11)6-12-13;1-6(2)7-3-10-9(4-8(7)11)12-5-13-10;1-6(2)7-3-8(11)10-9(4-7)13-5-12-10;1-8(2)9-4-6-12-10(7-9)3-5-11-12;1-7(2)8-3-4-9-10(5-8)12-6-11-9;/h4-5,7-8H,3,6H2,1-2H3;2*4-7H,1-3H3;4-6H,1-3H3;2*4-8H,1-3H3;2*4-7H,1-3H3;3*3-7H,1-2H3;2*3-6H,1-2H3;3-8H,1-2H3;3-7H,1-2H3;1H4
InChIKeyKXJGFBFFQWMPAG-UHFFFAOYSA-N
MW2793.85 g/mol
LogP48.06
Rot. Bonds15

About 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine

5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine (PubChem CID 159268158) has the molecular formula C160H186F8N22S7 and a molecular weight of 2793.85 g/mol. Its IUPAC name is 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine
PubChem CID159268158
Molecular FormulaC160H186F8N22S7
Molecular Weight2793.85 g/mol
Exact Mass2791.31
IUPAC Name5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine
SMILESC.C=C1Cc2ccc(C(C)C)cc2S1.CC(C)c1cc(F)c2ncsc2c1.CC(C)c1cc2ccnn2cc1F.CC(C)c1cc2scnc2cc1F.CC(C)c1ccc2ncsc2c1.CC(C)c1ccn2ncc(F)c2c1.CC(C)c1ccn2nccc2c1.CC(C)c1ccn2nccc2c1F.Cc1cc2c(F)c(C(C)C)ccn2n1.Cc1cn2nccc2cc1C(C)C.Cc1cnn2ccc(C(C)C)cc12.Cc1nc2cc(F)c(C(C)C)cc2s1.Cc1nc2ccc(C(C)C)cc2s1.Cc1nc2ccc(C(C)C)cc2s1.Cc1nn2ccc(C(C)C)cc2c1F
InChIInChI=1S/C12H14S.2C11H13FN2.C11H12FNS.2C11H14N2.2C11H13NS.3C10H11FN2.2C10H10FNS.C10H12N2.C10H11NS.CH4/c1-8(2)10-4-5-11-6-9(3)13-12(11)7-10;1-7(2)9-4-5-14-10(6-9)11(12)8(3)13-14;1-7(2)9-4-5-14-10(11(9)12)6-8(3)13-14;1-6(2)8-4-11-10(5-9(8)12)13-7(3)14-11;1-8(2)11-6-10-4-5-12-13(10)7-9(11)3;1-8(2)10-4-5-13-11(6-10)9(3)7-12-13;2*1-7(2)9-4-5-10-11(6-9)13-8(3)12-10;1-7(2)8-4-6-13-9(10(8)11)3-5-12-13;1-7(2)9-5-8-3-4-12-13(8)6-10(9)11;1-7(2)8-3-4-13-10(5-8)9(11)6-12-13;1-6(2)7-3-10-9(4-8(7)11)12-5-13-10;1-6(2)7-3-8(11)10-9(4-7)13-5-12-10;1-8(2)9-4-6-12-10(7-9)3-5-11-12;1-7(2)8-3-4-9-10(5-8)12-6-11-9;/h4-5,7-8H,3,6H2,1-2H3;2*4-7H,1-3H3;4-6H,1-3H3;2*4-8H,1-3H3;2*4-7H,1-3H3;3*3-7H,1-2H3;2*3-6H,1-2H3;3-8H,1-2H3;3-7H,1-2H3;1H4
InChIKeyKXJGFBFFQWMPAG-UHFFFAOYSA-N
XLogP48.06
TPSA215.74 Ų
H-Bond Donors
H-Bond Acceptors29
Rotatable Bonds15
Heavy Atoms197
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002793.85
LogP ≤ 548.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1029

Analyze 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine with MolForge

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Related Compounds

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CID 157363158
4-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N,N-dimethylaniline;N,N-dimethylmethanamine;bis(4,7-dimethyl-2-pyridin-4-yl-1,3-benzothiazole);4,7-dimethyl-2-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole;ethane;2-(4-fluorophenyl)-4,7-dimethyl-1,3-benzothiazole
CID 158625817
1-(Difluoromethyl)-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1-ethyl-4-(4-propan-2-ylphenyl)pyrazole;2-methyl-5-propan-2-ylindazole;1-methyl-4-(4-propan-2-ylphenyl)-3-(trifluoromethyl)pyrazole;3-(4-propan-2-ylphenyl)benzonitrile;4-(3-propan-2-ylphenyl)pyridine;5-(4-propan-2-ylphenyl)-1,3-thiazole;4-(4-propan-2-ylphenyl)-1-(2,2,2-trifluoroethyl)pyrazole;1,3,5-trimethyl-4-(4-propan-2-ylphenyl)pyrazole
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2-(1-Benzothiophen-2-yl)pyridine;2-(1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridine;2-(2,4-difluorophenyl)pyridine;2-(4-fluorophenyl)pyridine;2-phenyl-1,3-benzothiazole;2-phenylpyridine;2-thiophen-2-ylpyridine
CID 158813685
(4aS,8aS)-2-propan-2-yl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline;(4aR,8aS)-2-propan-2-yl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline;4,4-difluoro-2-propan-2-yl-1,3-dihydroisoquinoline;2,3-dimethyl-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine;1-methyl-6-propan-2-ylindazole;1-methyl-5-propan-2-yl-3-pyrazin-2-ylindazole;1-methyl-5-propan-2-yl-3-pyridin-4-ylindazole;4-methyl-5-(4-propan-2-yl-2-pyridinyl)-1H-isoindole;6-methyl-5-(4-propan-2-yl-2-pyridinyl)-1H-isoindole;7-methyl-5-(4-propan-2-yl-2-pyridinyl)-1H-isoindole;5-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-dihydroisoindole;2-propan-2-yl-3,4-dihydro-1H-2,6-naphthyridine;2-propan-2-yl-3,4-dihydro-1H-2,7-naphthyridine;7-propan-2-yl-6,8-dihydro-5H-1,7-naphthyridine;6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine;2-propan-2-yl-1,3-dihydropyrrolo[3,4-c]pyridine;6-propan-2-ylisoquinoline
CID 159219003
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(4aR,8aS)-2-propan-2-yl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline;(4aS,8aS)-2-propan-2-yl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline;4,4-difluoro-2-propan-2-yl-1,3-dihydroisoquinoline;1-methyl-6-propan-2-ylindazole;1-methyl-5-propan-2-yl-3-pyrazin-2-ylindazole;1-methyl-5-propan-2-yl-3-pyridin-4-ylindazole;7-methyl-5-(4-propan-2-yl-2-pyridinyl)-1H-isoindole;5-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-3,4-dihydro-1H-2,6-naphthyridine;2-propan-2-yl-3,4-dihydro-1H-2,7-naphthyridine;7-propan-2-yl-6,8-dihydro-5H-1,7-naphthyridine;6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine;2-propan-2-yl-1,3-dihydropyrrolo[3,4-c]pyridine;6-propan-2-ylisoquinoline
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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine?
The IUPAC name of 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine (CID 159268158) is 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine.
What is the SMILES notation for 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine?
The canonical SMILES for 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine is C.C=C1Cc2ccc(C(C)C)cc2S1.CC(C)c1cc(F)c2ncsc2c1.CC(C)c1cc2ccnn2cc1F.CC(C)c1cc2scnc2cc1F.CC(C)c1ccc2ncsc2c1.CC(C)c1ccn2ncc(F)c2c1.CC(C)c1ccn2nccc2c1.CC(C)c1ccn2nccc2c1F.Cc1cc2c(F)c(C(C)C)ccn2n1.Cc1cn2nccc2cc1C(C)C.Cc1cnn2ccc(C(C)C)cc12.Cc1nc2cc(F)c(C(C)C)cc2s1.Cc1nc2ccc(C(C)C)cc2s1.Cc1nc2ccc(C(C)C)cc2s1.Cc1nn2ccc(C(C)C)cc2c1F.
What is the InChIKey of 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine?
The InChIKey is KXJGFBFFQWMPAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14S.2C11H13FN2.C11H12FNS.2C11H14N2.2C11H13NS.3C10H11FN2.2C10H10FNS.C10H12N2.C10H11NS.CH4/c1-8(2)10-4-5-11-6-9(3)13-12(11)7-10;1-7(2)9-4-5-14-10(6-9)11(12)8(3)13-14;1-7(2)9-4-5-14-10(11(9)12)6-8(3)13-14;1-6(2)8-4-11-10(5-9(8)12)13-7(3)14-11;1-8(2)11-6-10-4-5-12-13(10)7-9(11)3;1-8(2)10-4-5-13-11(6-10)9(3)7-12-13;2*1-7(2)9-4-5-10-11(6-9)13-8(3)12-10;1-7(2)8-4-6-13-9(10(8)11)3-5-12-13;1-7(2)9-5-8-3-4-12-13(8)6-10(9)11;1-7(2)8-3-4-13-10(5-8)9(11)6-12-13;1-6(2)7-3-10-9(4-8(7)11)12-5-13-10;1-6(2)7-3-8(11)10-9(4-7)13-5-12-10;1-8(2)9-4-6-12-10(7-9)3-5-11-12;1-7(2)8-3-4-9-10(5-8)12-6-11-9;/h4-5,7-8H,3,6H2,1-2H3;2*4-7H,1-3H3;4-6H,1-3H3;2*4-8H,1-3H3;2*4-7H,1-3H3;3*3-7H,1-2H3;2*3-6H,1-2H3;3-8H,1-2H3;3-7H,1-2H3;1H4.
What are the key properties of 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine?
5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine has a molecular weight of 2793.85 g/mol, XLogP of 48.06, 15 rotatable bonds, 0 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-ylpyrazolo[1,5-a]pyridine is sourced from PubChem (CID 159268158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).