6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole

C155H191N13O3S3 — CID 158088482

IUPAC6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole
SMILESC.CC(C)(C)c1ccc2c(c1)N=CC2.CC(C)(C)c1ccc2cc[nH]c2c1.CC(C)(C)c1ccc2ccncc2c1.CC(C)(C)c1ccc2ccoc2c1.CC(C)(C)c1ccc2ccsc2c1.CC(C)(C)c1ccc2ncccc2c1.CC(C)c1ccc2c(c1)N=CC2.CCn1cnc2cc(C(C)C)ccc21.Cc1ccc2sc(C)nc2c1.Cc1nc2cc(C(C)(C)C)ccc2o1.Cc1nc2ccc(C(C)(C)C)cc2o1.Cc1nc2ccc(C(C)(C)C)cc2s1.Cn1cnc2cc(C(C)(C)C)ccc21
InChIInChI=1S/2C13H15N.2C12H16N2.2C12H15NO.C12H15NS.2C12H15N.C12H14O.C12H14S.C11H13N.C9H9NS.CH4/c1-13(2,3)12-5-4-10-6-7-14-9-11(10)8-12;1-13(2,3)11-6-7-12-10(9-11)5-4-8-14-12;1-12(2,3)9-5-6-11-10(7-9)13-8-14(11)4;1-4-14-8-13-11-7-10(9(2)3)5-6-12(11)14;1-8-13-10-7-9(12(2,3)4)5-6-11(10)14-8;2*1-8-13-10-6-5-9(12(2,3)4)7-11(10)14-8;4*1-12(2,3)10-5-4-9-6-7-13-11(9)8-10;1-8(2)10-4-3-9-5-6-12-11(9)7-10;1-6-3-4-9-8(5-6)10-7(2)11-9;/h2*4-9H,1-3H3;5-8H,1-4H3;5-9H,4H2,1-3H3;3*5-7H,1-4H3;4-5,7-8H,6H2,1-3H3;4-8,13H,1-3H3;2*4-8H,1-3H3;3-4,6-8H,5H2,1-2H3;3-5H,1-2H3;1H4
InChIKeyFNUMHJKWCQBIGL-UHFFFAOYSA-N
MW2380.52 g/mol
LogP45.14
Rot. Bonds3

About 6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole

6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole (PubChem CID 158088482) has the molecular formula C155H191N13O3S3 and a molecular weight of 2380.52 g/mol. Its IUPAC name is 6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole.

Molecular Properties

Compound Name6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole
PubChem CID158088482
Molecular FormulaC155H191N13O3S3
Molecular Weight2380.52 g/mol
Exact Mass2378.44
IUPAC Name6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole
SMILESC.CC(C)(C)c1ccc2c(c1)N=CC2.CC(C)(C)c1ccc2cc[nH]c2c1.CC(C)(C)c1ccc2ccncc2c1.CC(C)(C)c1ccc2ccoc2c1.CC(C)(C)c1ccc2ccsc2c1.CC(C)(C)c1ccc2ncccc2c1.CC(C)c1ccc2c(c1)N=CC2.CCn1cnc2cc(C(C)C)ccc21.Cc1ccc2sc(C)nc2c1.Cc1nc2cc(C(C)(C)C)ccc2o1.Cc1nc2ccc(C(C)(C)C)cc2o1.Cc1nc2ccc(C(C)(C)C)cc2s1.Cn1cnc2cc(C(C)(C)C)ccc21
InChIInChI=1S/2C13H15N.2C12H16N2.2C12H15NO.C12H15NS.2C12H15N.C12H14O.C12H14S.C11H13N.C9H9NS.CH4/c1-13(2,3)12-5-4-10-6-7-14-9-11(10)8-12;1-13(2,3)11-6-7-12-10(9-11)5-4-8-14-12;1-12(2,3)9-5-6-11-10(7-9)13-8-14(11)4;1-4-14-8-13-11-7-10(9(2)3)5-6-12(11)14;1-8-13-10-7-9(12(2,3)4)5-6-11(10)14-8;2*1-8-13-10-6-5-9(12(2,3)4)7-11(10)14-8;4*1-12(2,3)10-5-4-9-6-7-13-11(9)8-10;1-8(2)10-4-3-9-5-6-12-11(9)7-10;1-6-3-4-9-8(5-6)10-7(2)11-9;/h2*4-9H,1-3H3;5-8H,1-4H3;5-9H,4H2,1-3H3;3*5-7H,1-4H3;4-5,7-8H,6H2,1-3H3;4-8,13H,1-3H3;2*4-8H,1-3H3;3-4,6-8H,5H2,1-2H3;3-5H,1-2H3;1H4
InChIKeyFNUMHJKWCQBIGL-UHFFFAOYSA-N
XLogP45.14
TPSA192.91 Ų
H-Bond Donors1
H-Bond Acceptors18
Rotatable Bonds3
Heavy Atoms174
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002380.52
LogP ≤ 545.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1018

Analyze 6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole with MolForge

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Launch Full Analysis

Related Compounds

1-methoxy-3-propan-2-ylbenzene;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,3-benzothiazol-2-amine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2H-benzotriazole;6-propan-2-yl-1,2-benzoxazol-3-amine;6-propan-2-yl-1,3-benzoxazol-2-amine;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-8-(trifluoromethyl)quinoline
CID 157276904
1-cyclohexyl-3-propan-2-ylbenzene;1-cyclopentyl-3-propan-2-ylbenzene;2-methyl-4-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylimidazo[1,2-a]pyridine;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;1-(2-propan-2-ylphenyl)pyrrolidine;2-propan-2-ylquinazoline;3-propan-2-ylquinoline;4-propan-2-ylquinoline;2-propan-2-ylquinoxaline;2-propan-2-yl-3-(trifluoromethyl)pyridine
CID 157464689
benzaldehyde;benzonitrile;1,3-benzothiazole;1-benzothiophene;1,3-benzoxazole;2-(1,1-difluoroethyl)-1,3-bis(trifluoromethyl)benzene;3H-indole;4-methylidenecyclopent-2-en-1-one;4H-naphthalen-1-one;1,6-naphthyridine;phenanthridine;1H-phenanthro[9,10-d]imidazole;1,10-phenanthroline;2-phenyl-1,3-benzoxazole;2-pyridin-2-ylpyridine;quinoline
CID 158538440
CID 158633368
CID 158633368
2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylimidazo[1,2-a]pyridine;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-ylnaphthalene;2-propan-2-ylquinazoline;3-propan-2-ylquinoline;4-propan-2-ylquinoline;2-propan-2-ylquinoxaline;2-propan-2-yl-[1,3]thiazolo[4,5-b]pyridine;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine;2-propan-2-yl-[1,3]thiazolo[5,4-c]pyridine;2-propan-2-yl-4-(trifluoromethyl)pyridine;2-propan-2-yl-6-(trifluoromethyl)pyridine;3-propan-2-yl-5-(trifluoromethyl)pyridine;4-propan-2-yl-2-(trifluoromethyl)pyridine
CID 159430087
CID 160156765
CID 160156765
2-[3-(10b,10c-Dihydropyren-4-yl)-5-pyridin-3-ylphenyl]-1,3-benzothiazole;5-[6-(1-phenylbenzimidazol-2-yl)-2-pyridin-3-ylpyrimidin-4-yl]-1,10-phenanthroline;2-(4-pyridin-3-yl-6-pyrimidin-2-yl-1,3,5-triazin-2-yl)-1,3-benzoxazole;2-(4-pyridin-3-yl-6-pyrimidin-2-yl-1,3,5-triazin-2-yl)-6-(trifluoromethyl)-1,3-benzoxazole
CID 160449291
2-(1-Benzothiophen-2-yl)pyridine;2-(9,9-diethylfluoren-2-yl)-1-phenylbenzimidazole;4,7-diphenylbenzo[h]quinoline;9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole;2-(5-methylthiophen-2-yl)pyridine;2-naphthalen-1-yl-1,3-benzoxazole;2-phenyl-1,3-benzothiazole;2-phenylpyridine;2-quinolin-2-ylquinoline;2-thiophen-2-yl-5-(trifluoromethyl)pyridine
CID 160455830
2-(1-benzothiophen-2-yl)pyridine;2-[3,5-bis(trifluoromethyl)phenyl]pyridine;2-(2,4-difluorophenyl)-N,N-dimethylpyridin-4-amine;2-(2,4-difluorophenyl)-4-methoxypyridine;2-(2,4-difluorophenyl)pyridine;4,7-diphenylbenzo[h]quinoline;9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole;2-(5-methylthiophen-2-yl)pyridine;2-naphthalen-1-yl-1,3-benzoxazole;2-phenyl-1,3-benzothiazole;bis(2-phenylpyridine);2-thiophen-2-yl-5-(trifluoromethyl)pyridine
CID 160694799
1-Fluoro-4-propan-2-ylbenzene;1-isocyano-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methyl-2-propan-2-ylbenzimidazole;1-phenyl-2-propan-2-ylbenzimidazole;4-phenyl-2-propan-2-ylquinoline;2-propan-2-yl-1-benzofuran;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylfuran;1-propan-2-ylisoquinoline;2-propan-2-yl-1,10-phenanthroline;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-ylquinoline;6-propan-2-ylquinoline;2-propan-2-ylthiophene;2-propan-2-yl-1,3,5-triazine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane
CID 160856179
N,N-dimethyl-6-propan-2-yl-1H-benzimidazol-2-amine;N,N-dimethyl-6-propan-2-yl-1,3-benzothiazol-2-amine;N,N-dimethyl-6-propan-2-yl-1,2-benzoxazol-3-amine;N,N-dimethyl-6-propan-2-yl-1,3-benzoxazol-2-amine;2-ethyl-6-propan-2-yl-1,2,3,4-tetrahydronaphthalene;N-methyl-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine;1-methyl-6-propan-2-yl-1-(trifluoromethyl)-3,4-dihydro-2H-isoquinoline;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-yl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine;3-propan-2-yl-5,6,7,8-tetrahydro-1,7-naphthyridine;2-propan-2-yl-4,5,6,7-tetrahydro-[1,3]oxazolo[4,5-c]pyridine;2-propan-2-yl-5,6,7,8-tetrahydropyrido[3,4-b]pyrazine;3-propan-2-yl-5,6,7,8-tetrahydropyrido[3,4-b]pyrazine;2-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-4,5,6,7-tetrahydro-[1,3]thiazolo[4,5-c]pyridine;2-propan-2-yl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
CID 160863111
N,N-dimethyl-6-propan-2-yl-1H-benzimidazol-2-amine;N,N-dimethyl-6-propan-2-yl-1,3-benzothiazol-2-amine;N,N-dimethyl-6-propan-2-yl-1,2-benzoxazol-3-amine;N,N-dimethyl-6-propan-2-yl-1,3-benzoxazol-2-amine;1,2-dimethyl-6-propan-2-yl-1-(trifluoromethyl)-3,4-dihydroisoquinoline;1-methyl-6-propan-2-yl-1-(trifluoromethyl)-3,4-dihydro-2H-isoquinoline;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-yl-4,5,6,7-tetrahydro-[1,3]oxazolo[4,5-c]pyridine;2-propan-2-yl-5,6,7,8-tetrahydropyrido[3,4-b]pyrazine;3-propan-2-yl-5,6,7,8-tetrahydropyrido[3,4-b]pyrazine;2-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-4,5,6,7-tetrahydro-[1,3]thiazolo[4,5-c]pyridine;2-propan-2-yl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
CID 160944258

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole?
The IUPAC name of 6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole (CID 158088482) is 6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole.
What is the SMILES notation for 6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole?
The canonical SMILES for 6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole is C.CC(C)(C)c1ccc2c(c1)N=CC2.CC(C)(C)c1ccc2cc[nH]c2c1.CC(C)(C)c1ccc2ccncc2c1.CC(C)(C)c1ccc2ccoc2c1.CC(C)(C)c1ccc2ccsc2c1.CC(C)(C)c1ccc2ncccc2c1.CC(C)c1ccc2c(c1)N=CC2.CCn1cnc2cc(C(C)C)ccc21.Cc1ccc2sc(C)nc2c1.Cc1nc2cc(C(C)(C)C)ccc2o1.Cc1nc2ccc(C(C)(C)C)cc2o1.Cc1nc2ccc(C(C)(C)C)cc2s1.Cn1cnc2cc(C(C)(C)C)ccc21.
What is the InChIKey of 6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole?
The InChIKey is FNUMHJKWCQBIGL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C13H15N.2C12H16N2.2C12H15NO.C12H15NS.2C12H15N.C12H14O.C12H14S.C11H13N.C9H9NS.CH4/c1-13(2,3)12-5-4-10-6-7-14-9-11(10)8-12;1-13(2,3)11-6-7-12-10(9-11)5-4-8-14-12;1-12(2,3)9-5-6-11-10(7-9)13-8-14(11)4;1-4-14-8-13-11-7-10(9(2)3)5-6-12(11)14;1-8-13-10-7-9(12(2,3)4)5-6-11(10)14-8;2*1-8-13-10-6-5-9(12(2,3)4)7-11(10)14-8;4*1-12(2,3)10-5-4-9-6-7-13-11(9)8-10;1-8(2)10-4-3-9-5-6-12-11(9)7-10;1-6-3-4-9-8(5-6)10-7(2)11-9;/h2*4-9H,1-3H3;5-8H,1-4H3;5-9H,4H2,1-3H3;3*5-7H,1-4H3;4-5,7-8H,6H2,1-3H3;4-8,13H,1-3H3;2*4-8H,1-3H3;3-4,6-8H,5H2,1-2H3;3-5H,1-2H3;1H4.
What are the key properties of 6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole?
6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole has a molecular weight of 2380.52 g/mol, XLogP of 45.14, 3 rotatable bonds, 1 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole is sourced from PubChem (CID 158088482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).