6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate

C148H183N19O11 — CID 159366755

IUPAC6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate
SMILESCC(C)(C)c1ccc2[nH]c(=O)cc(O)c2c1.CC(C)(C)c1ccc2[nH]c(=O)ccc2c1.CC(C)(C)c1ccc2[nH]cc(C(N)=O)c2c1.CC(C)(C)c1ccc2[nH]cc(CC(=O)O)c2c1.CC(C)(C)c1ccc2[nH]ccc2c1.CC(C)(C)c1ccc2[nH]nc(C(=O)O)c2c1.CC(C)(C)c1ccc2c(N)n[nH]c2c1.CC(C)(C)c1ccc2c(c1)NC(=O)CC2.CC(C)(C)c1ccc2cc[nH]c2c1.CC(C)(C)c1ccc2cn[nH]c2c1.CC(C)(C)c1ccc2nc[nH]c2c1.COC(=O)c1n[nH]c2ccc(C(C)(C)C)cc12
InChIInChI=1S/C14H17NO2.C13H16N2O2.C13H16N2O.C13H15NO2.C13H15NO.C13H17NO.C12H14N2O2.2C12H15N.C11H15N3.2C11H14N2/c1-14(2,3)10-4-5-12-11(7-10)9(8-15-12)6-13(16)17;1-13(2,3)8-5-6-10-9(7-8)11(15-14-10)12(16)17-4;1-13(2,3)8-4-5-11-9(6-8)10(7-15-11)12(14)16;1-13(2,3)8-4-5-10-9(6-8)11(15)7-12(16)14-10;1-13(2,3)10-5-6-11-9(8-10)4-7-12(15)14-11;1-13(2,3)10-6-4-9-5-7-12(15)14-11(9)8-10;1-12(2,3)7-4-5-9-8(6-7)10(11(15)16)14-13-9;1-12(2,3)10-4-5-11-9(8-10)6-7-13-11;1-12(2,3)10-5-4-9-6-7-13-11(9)8-10;1-11(2,3)7-4-5-8-9(6-7)13-14-10(8)12;1-11(2,3)9-5-4-8-7-12-13-10(8)6-9;1-11(2,3)8-4-5-9-10(6-8)13-7-12-9/h4-5,7-8,15H,6H2,1-3H3,(H,16,17);5-7H,1-4H3,(H,14,15);4-7,15H,1-3H3,(H2,14,16);4-7H,1-3H3,(H2,14,15,16);4-8H,1-3H3,(H,14,15);4,6,8H,5,7H2,1-3H3,(H,14,15);4-6H,1-3H3,(H,13,14)(H,15,16);2*4-8,13H,1-3H3;4-6H,1-3H3,(H3,12,13,14);2*4-7H,1-3H3,(H,12,13)
InChIKeyLJFNAGUGINWFAA-UHFFFAOYSA-N
MW2404.21 g/mol
LogP34.18
Rot. Bonds5

About 6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate

6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate (PubChem CID 159366755) has the molecular formula C148H183N19O11 and a molecular weight of 2404.21 g/mol. Its IUPAC name is 6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate.

Molecular Properties

Compound Name6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate
PubChem CID159366755
Molecular FormulaC148H183N19O11
Molecular Weight2404.21 g/mol
Exact Mass2402.43
IUPAC Name6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate
SMILESCC(C)(C)c1ccc2[nH]c(=O)cc(O)c2c1.CC(C)(C)c1ccc2[nH]c(=O)ccc2c1.CC(C)(C)c1ccc2[nH]cc(C(N)=O)c2c1.CC(C)(C)c1ccc2[nH]cc(CC(=O)O)c2c1.CC(C)(C)c1ccc2[nH]ccc2c1.CC(C)(C)c1ccc2[nH]nc(C(=O)O)c2c1.CC(C)(C)c1ccc2c(N)n[nH]c2c1.CC(C)(C)c1ccc2c(c1)NC(=O)CC2.CC(C)(C)c1ccc2cc[nH]c2c1.CC(C)(C)c1ccc2cn[nH]c2c1.CC(C)(C)c1ccc2nc[nH]c2c1.COC(=O)c1n[nH]c2ccc(C(C)(C)C)cc12
InChIInChI=1S/C14H17NO2.C13H16N2O2.C13H16N2O.C13H15NO2.C13H15NO.C13H17NO.C12H14N2O2.2C12H15N.C11H15N3.2C11H14N2/c1-14(2,3)10-4-5-12-11(7-10)9(8-15-12)6-13(16)17;1-13(2,3)8-5-6-10-9(7-8)11(15-14-10)12(16)17-4;1-13(2,3)8-4-5-11-9(6-8)10(7-15-11)12(14)16;1-13(2,3)8-4-5-10-9(6-8)11(15)7-12(16)14-10;1-13(2,3)10-5-6-11-9(8-10)4-7-12(15)14-11;1-13(2,3)10-6-4-9-5-7-12(15)14-11(9)8-10;1-12(2,3)7-4-5-9-8(6-7)10(11(15)16)14-13-9;1-12(2,3)10-4-5-11-9(8-10)6-7-13-11;1-12(2,3)10-5-4-9-6-7-13-11(9)8-10;1-11(2,3)7-4-5-8-9(6-7)13-14-10(8)12;1-11(2,3)9-5-4-8-7-12-13-10(8)6-9;1-11(2,3)8-4-5-9-10(6-8)13-7-12-9/h4-5,7-8,15H,6H2,1-3H3,(H,16,17);5-7H,1-4H3,(H,14,15);4-7,15H,1-3H3,(H2,14,16);4-7H,1-3H3,(H2,14,15,16);4-8H,1-3H3,(H,14,15);4,6,8H,5,7H2,1-3H3,(H,14,15);4-6H,1-3H3,(H,13,14)(H,15,16);2*4-8,13H,1-3H3;4-6H,1-3H3,(H3,12,13,14);2*4-7H,1-3H3,(H,12,13)
InChIKeyLJFNAGUGINWFAA-UHFFFAOYSA-N
XLogP34.18
TPSA491.62 Ų
H-Bond Donors17
H-Bond Acceptors15
Rotatable Bonds5
Heavy Atoms178
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002404.21
LogP ≤ 534.18
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1015

Analyze 6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate with MolForge

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Launch Full Analysis

Related Compounds

ethyl 2-[2-(6-imidazol-1-ylpyridazin-3-yl)-2-oxoethyl]cycloheptene-1-carboxylate;N-[1-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)naphthalen-2-yl]-6-imidazol-1-ylpyridazine-3-carboxamide;6-imidazol-1-yl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]pyridazine-3-carboxamide;methyl 5-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-1H-indazole-6-carboxylate;methyl 4-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-1-methylpyrazole-3-carboxylate
CID 162292117
ethyl 2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carboxylate;N-[2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4-methylphenyl]-6-imidazol-1-ylpyridazine-3-carboxamide;6-imidazol-1-yl-N-[3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyridazine-3-carboxamide;methyl 5-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-1H-indazole-6-carboxylate;methyl 4-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-1-methylpyrazole-3-carboxylate;methyl 3-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5,6,7,8-tetrahydronaphthalene-2-carboxylate
CID 162292175
(2S,4R)-1-[(2S)-2-[7-[[4-[(4S)-5-aza-2-azoniabicyclo[2.2.1]hept-1-en-2-yl]-6-cyclopropyl-7-(6-fluoro-5-methyl-1H-indazol-4-yl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-oxopyrido[4,3-d]pyrimidin-8-yl]oxymethyl]-4-oxo-5H-pyrazolo[3,4-c]quinolin-2-yl]-3-methylbutanoyl]-N-[(1R)-1-[4-(2-ethylpyrazol-3-yl)phenyl]-2-hydroxyethyl]-4-hydroxypyrrolidine-2-carboxamide
CID 176976698
propan-2-yl 6-[4-[2-[6-(1H-indazol-5-ylamino)-2-[2-[(pyridazine-4-carbonylamino)methyl]-1H-indol-6-yl]pyrimidin-4-yl]-4-(1H-pyrazol-4-yl)anilino]pyrimidin-2-yl]-4-[[2-[7-[4-(1H-indazol-5-ylamino)pyrimidin-2-yl]-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]acetyl]oxymethyl]-1H-indole-2-carboxylate
CID 137387420
6-tert-butyl-1H-benzimidazole;7-tert-butyl-2,3-dihydroisoquinoline-1,4-dione;7-tert-butyl-3,4-dihydro-2H-isoquinolin-1-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;7-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;7-tert-butyl-2H-isoquinolin-1-one;6-tert-butyl-1,2,3,4-tetrahydroisoquinoline
CID 157205753
4-[7-amino-6-bromo-3-(5-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]cyclohexane-1-carboxylic acid;4-(7-amino-6-bromo-3-quinolin-6-ylpyrazolo[1,5-a]pyrimidin-5-yl)cyclohexane-1-carboxylic acid;8-(7-amino-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;methyl 4-(7-amino-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1H-pyrrole-2-carboxylate;methyl 1-(7-amino-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidine-3-carboxylate
CID 157445220
6-tert-butyl-1H-benzimidazole;7-tert-butyl-2,3-dihydroisoquinoline-1,4-dione;7-tert-butyl-3,4-dihydro-2H-isoquinolin-1-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;7-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;7-tert-butyl-2H-isoquinolin-1-one;6-tert-butyl-1,2,3,4-tetrahydroisoquinoline;methane
CID 157483724
3-tert-butylimidazo[1,2-b]pyridazine;6-tert-butyl-1H-indole-4-carboxylic acid;4-tert-butylisoquinoline;5-tert-butyl-3-methyl-2H-indazole;5-tert-butylquinoline;methane;methyl 3-tert-butyl-4-methylbenzoate
CID 157544281
6-methyl-1H-benzimidazole;5-methyl-1H-indazole;2-methyl-1H-indole;5-methyl-1H-indole;6-methyl-1H-indole;2-methyl-1H-indole-5-carboxylic acid;2-methyl-1H-indole-6-carboxylic acid;methyl 2-methyl-1H-indole-5-carboxylate
CID 157560965
5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-1-methyl-3-propan-2-ylindole;1,2-dimethyl-7-propan-2-ylindole-3-carboxylic acid;1,5-dimethyl-7-propan-2-ylindole-2-carboxylic acid;1-methyl-5,7-di(propan-2-yl)indole-2-carboxamide;1-methyl-5-(4-methylpyrimidin-2-yl)-3-propan-2-ylindole;2-(1-methyl-3-propan-2-ylindol-5-yl)-5-phenyl-1,3,4-oxadiazole;1-methyl-3-propan-2-yl-5-(1H-1,2,4-triazol-5-yl)indole
CID 158106393
2-ethyl-N-[3-[2-hydroxy-3-[(5-methyl-1H-pyrazol-3-yl)iminomethyl]-1H-indole-5-carbonyl]phenyl]-5-methylpyrazole-3-carboxamide;2-ethyl-N-[3-[2-hydroxy-3-(1H-pyrazol-5-yliminomethyl)-1H-indole-5-carbonyl]phenyl]-5-methylpyrazole-3-carboxamide;N-[3-[2-hydroxy-3-[(5-methyl-1H-pyrazol-3-yl)iminomethyl]-1H-indole-5-carbonyl]phenyl]-1-methylimidazole-2-carboxamide;N-[3-[2-hydroxy-3-(1H-pyrazol-5-yliminomethyl)-1H-indole-6-carbonyl]phenyl]-2,5-dimethylpyrazole-3-carboxamide;N-[3-[2-hydroxy-3-(1H-pyrazol-5-yliminomethyl)-1H-indole-5-carbonyl]phenyl]-1-methylpyrazole-4-carboxamide
CID 158598951
ethyl 2-(3H-benzimidazol-5-yl)-7-ethylpyrazolo[1,5-a]pyrimidine-5-carboxylate;ethyl 7-ethyl-2-(1-methylbenzimidazol-5-yl)pyrazolo[1,5-a]pyrimidine-5-carboxylate;ethyl 7-ethyl-2-(1-methyl-2,3-dihydroindol-5-yl)pyrazolo[1,5-a]pyrimidine-5-carboxylate;ethyl 7-ethyl-2-(2-methylquinolin-6-yl)pyrazolo[1,5-a]pyrimidine-5-carboxylate;ethyl 7-ethyl-2-(6-oxo-5H-naphthalen-2-yl)pyrazolo[1,5-a]pyrimidine-5-carboxylate;ethyl 7-ethyl-2-quinolin-6-ylpyrazolo[1,5-a]pyrimidine-5-carboxylate
CID 158618825

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate?
The IUPAC name of 6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate (CID 159366755) is 6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate.
What is the SMILES notation for 6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate?
The canonical SMILES for 6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate is CC(C)(C)c1ccc2[nH]c(=O)cc(O)c2c1.CC(C)(C)c1ccc2[nH]c(=O)ccc2c1.CC(C)(C)c1ccc2[nH]cc(C(N)=O)c2c1.CC(C)(C)c1ccc2[nH]cc(CC(=O)O)c2c1.CC(C)(C)c1ccc2[nH]ccc2c1.CC(C)(C)c1ccc2[nH]nc(C(=O)O)c2c1.CC(C)(C)c1ccc2c(N)n[nH]c2c1.CC(C)(C)c1ccc2c(c1)NC(=O)CC2.CC(C)(C)c1ccc2cc[nH]c2c1.CC(C)(C)c1ccc2cn[nH]c2c1.CC(C)(C)c1ccc2nc[nH]c2c1.COC(=O)c1n[nH]c2ccc(C(C)(C)C)cc12.
What is the InChIKey of 6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate?
The InChIKey is LJFNAGUGINWFAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2.C13H16N2O2.C13H16N2O.C13H15NO2.C13H15NO.C13H17NO.C12H14N2O2.2C12H15N.C11H15N3.2C11H14N2/c1-14(2,3)10-4-5-12-11(7-10)9(8-15-12)6-13(16)17;1-13(2,3)8-5-6-10-9(7-8)11(15-14-10)12(16)17-4;1-13(2,3)8-4-5-11-9(6-8)10(7-15-11)12(14)16;1-13(2,3)8-4-5-10-9(6-8)11(15)7-12(16)14-10;1-13(2,3)10-5-6-11-9(8-10)4-7-12(15)14-11;1-13(2,3)10-6-4-9-5-7-12(15)14-11(9)8-10;1-12(2,3)7-4-5-9-8(6-7)10(11(15)16)14-13-9;1-12(2,3)10-4-5-11-9(8-10)6-7-13-11;1-12(2,3)10-5-4-9-6-7-13-11(9)8-10;1-11(2,3)7-4-5-8-9(6-7)13-14-10(8)12;1-11(2,3)9-5-4-8-7-12-13-10(8)6-9;1-11(2,3)8-4-5-9-10(6-8)13-7-12-9/h4-5,7-8,15H,6H2,1-3H3,(H,16,17);5-7H,1-4H3,(H,14,15);4-7,15H,1-3H3,(H2,14,16);4-7H,1-3H3,(H2,14,15,16);4-8H,1-3H3,(H,14,15);4,6,8H,5,7H2,1-3H3,(H,14,15);4-6H,1-3H3,(H,13,14)(H,15,16);2*4-8,13H,1-3H3;4-6H,1-3H3,(H3,12,13,14);2*4-7H,1-3H3,(H,12,13).
What are the key properties of 6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate?
6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate has a molecular weight of 2404.21 g/mol, XLogP of 34.18, 5 rotatable bonds, 17 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-1H-benzimidazole;7-tert-butyl-3,4-dihydro-1H-quinolin-2-one;6-tert-butyl-4-hydroxy-1H-quinolin-2-one;6-tert-butyl-1H-indazol-3-amine;6-tert-butyl-1H-indazole;5-tert-butyl-1H-indazole-3-carboxylic acid;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;5-tert-butyl-1H-indole-3-carboxamide;2-(5-tert-butyl-1H-indol-3-yl)acetic acid;6-tert-butyl-1H-quinolin-2-one;methyl 5-tert-butyl-1H-indazole-3-carboxylate is sourced from PubChem (CID 159366755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).