2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline

C142H203N21O6S3 — CID 161149827

IUPAC2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline
SMILESCC(C)(C)c1cccc2c(N)ncnc12.CC(C)(C)c1cccc2cncnc12.CC(C)(C)c1nc2ccccc2[nH]1.CN(C)CCN(C)S(=O)(=O)c1ccccc1C(C)(C)C.CN(C)c1cccc(C(C)(C)C)c1S(N)(=O)=O.CN(c1ccccc1C(C)(C)C)S(C)(=O)=O.CN1CCN(c2cccc(C(C)(C)C)c2)CC1.Cc1cn(C)c2cccc(C(C)(C)C)c12.Cc1nn(C)c2cccc(C(C)(C)C)c12.Cn1cnc(-c2ccccc2C(C)(C)C)c1.Cn1ncc2ccc(C(C)(C)C)cc21
InChIInChI=1S/C15H26N2O2S.C15H24N2.C14H18N2.C14H19N.C13H18N2.C12H15N3.C12H20N2O2S.C12H16N2.C12H14N2.C12H19NO2S.C11H14N2/c1-15(2,3)13-9-7-8-10-14(13)20(18,19)17(6)12-11-16(4)5;1-15(2,3)13-6-5-7-14(12-13)17-10-8-16(4)9-11-17;1-14(2,3)12-8-6-5-7-11(12)13-9-16(4)10-15-13;1-10-9-15(5)12-8-6-7-11(13(10)12)14(2,3)4;1-9-12-10(13(2,3)4)7-6-8-11(12)15(5)14-9;1-12(2,3)9-6-4-5-8-10(9)14-7-15-11(8)13;1-12(2,3)9-7-6-8-10(14(4)5)11(9)17(13,15)16;1-12(2,3)10-6-5-9-8-13-14(4)11(9)7-10;1-12(2,3)10-6-4-5-9-7-13-8-14-11(9)10;1-12(2,3)10-8-6-7-9-11(10)13(4)16(5,14)15;1-11(2,3)10-12-8-6-4-5-7-9(8)13-10/h7-10H,11-12H2,1-6H3;5-7,12H,8-11H2,1-4H3;5-10H,1-4H3;6-9H,1-5H3;6-8H,1-5H3;4-7H,1-3H3,(H2,13,14,15);6-8H,1-5H3,(H2,13,15,16);5-8H,1-4H3;4-8H,1-3H3;6-9H,1-5H3;4-7H,1-3H3,(H,12,13)
InChIKeyUONKFOLKHBDSJF-UHFFFAOYSA-N
MW2396.53 g/mol
LogP30.50
Rot. Bonds11

About 2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline

2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline (PubChem CID 161149827) has the molecular formula C142H203N21O6S3 and a molecular weight of 2396.53 g/mol. Its IUPAC name is 2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline.

Molecular Properties

Compound Name2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline
PubChem CID161149827
Molecular FormulaC142H203N21O6S3
Molecular Weight2396.53 g/mol
Exact Mass2394.54
IUPAC Name2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline
SMILESCC(C)(C)c1cccc2c(N)ncnc12.CC(C)(C)c1cccc2cncnc12.CC(C)(C)c1nc2ccccc2[nH]1.CN(C)CCN(C)S(=O)(=O)c1ccccc1C(C)(C)C.CN(C)c1cccc(C(C)(C)C)c1S(N)(=O)=O.CN(c1ccccc1C(C)(C)C)S(C)(=O)=O.CN1CCN(c2cccc(C(C)(C)C)c2)CC1.Cc1cn(C)c2cccc(C(C)(C)C)c12.Cc1nn(C)c2cccc(C(C)(C)C)c12.Cn1cnc(-c2ccccc2C(C)(C)C)c1.Cn1ncc2ccc(C(C)(C)C)cc21
InChIInChI=1S/C15H26N2O2S.C15H24N2.C14H18N2.C14H19N.C13H18N2.C12H15N3.C12H20N2O2S.C12H16N2.C12H14N2.C12H19NO2S.C11H14N2/c1-15(2,3)13-9-7-8-10-14(13)20(18,19)17(6)12-11-16(4)5;1-15(2,3)13-6-5-7-14(12-13)17-10-8-16(4)9-11-17;1-14(2,3)12-8-6-5-7-11(12)13-9-16(4)10-15-13;1-10-9-15(5)12-8-6-7-11(13(10)12)14(2,3)4;1-9-12-10(13(2,3)4)7-6-8-11(12)15(5)14-9;1-12(2,3)9-6-4-5-8-10(9)14-7-15-11(8)13;1-12(2,3)9-7-6-8-10(14(4)5)11(9)17(13,15)16;1-12(2,3)10-6-5-9-8-13-14(4)11(9)7-10;1-12(2,3)10-6-4-5-9-7-13-8-14-11(9)10;1-12(2,3)10-8-6-7-9-11(10)13(4)16(5,14)15;1-11(2,3)10-12-8-6-4-5-7-9(8)13-10/h7-10H,11-12H2,1-6H3;5-7,12H,8-11H2,1-4H3;5-10H,1-4H3;6-9H,1-5H3;6-8H,1-5H3;4-7H,1-3H3,(H2,13,14,15);6-8H,1-5H3,(H2,13,15,16);5-8H,1-4H3;4-8H,1-3H3;6-9H,1-5H3;4-7H,1-3H3,(H,12,13)
InChIKeyUONKFOLKHBDSJF-UHFFFAOYSA-N
XLogP30.50
TPSA312.53 Ų
H-Bond Donors3
H-Bond Acceptors23
Rotatable Bonds11
Heavy Atoms172
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002396.53
LogP ≤ 530.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1023

Analyze 2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline with MolForge

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Related Compounds

N-[[3-fluoro-5-[2-[5-[5-[[3-[7-[3-fluoro-5-(methanesulfonamidomethyl)phenyl]-2-[5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-1H-benzimidazol-4-yl]piperidin-1-yl]methyl]-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-1H-benzimidazol-4-yl]phenyl]methyl]methanesulfonamide
CID 137117819
benzenesulfonic acid;chloroplatinum(1+);9-[3-(2,6-dimethyl-4-phenylphenyl)-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]pyrido[2,3-b]indole;2-(3-methyl-2H-benzimidazol-2-id-1-yl)-7-phenyl-9-pyridin-2-yl-1H-carbazol-1-ide;11-[3-[4-(4-phenylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]pyrido[2,3-b][1]benzazepine;bis(platinum(2+));trifluoromethanesulfonic acid
CID 158056165
3-(2-amino-1-ethylbenzimidazol-5-yl)-2-(2H-tetrazol-5-yl)-6-(trifluoromethyl)benzenesulfonamide;3-(1-aminoisoquinolin-6-yl)-2-(2H-tetrazol-5-yl)-6-(trifluoromethyl)benzenesulfonamide;3-(4-aminoquinazolin-7-yl)-2-(2H-tetrazol-5-yl)-6-(trifluoromethyl)benzenesulfonamide;3-(2,4-diaminoquinazolin-7-yl)-2-(2H-tetrazol-5-yl)-6-(trifluoromethyl)benzenesulfonamide;3-imidazo[1,2-a]pyridin-3-yl-2-(2H-tetrazol-5-yl)-6-(trifluoromethyl)benzenesulfonamide;3-(4-methyl-3-pyridinyl)-2-(2H-tetrazol-5-yl)-6-(trifluoromethyl)benzenesulfonamide
CID 158224630
benzenesulfonic acid;chloropalladium(1+);9-[3-(2,6-dimethyl-4-phenylphenyl)-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]pyrido[2,3-b]indole;2-(3-methyl-2H-benzimidazol-2-id-1-yl)-7-phenyl-9-pyridin-2-yl-1H-carbazol-1-ide;bis(palladium(2+));11-[3-[4-(4-phenylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]pyrido[2,3-b][1]benzazepine;trifluoromethanesulfonic acid
CID 159191989
3-fluoro-5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]pyridin-2-amine;6-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]-1H-indazol-3-amine;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]-1H-pyrrolo[3,2-b]pyridine;6-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]quinolin-4-amine;7-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]quinolin-4-amine;3-(4-piperidin-4-ylphenyl)-6-propyl-2-(3H-1,2,4-triazol-5-yl)benzenesulfonamide
CID 159588387
3-(2-amino-1H-benzimidazol-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide;3-(2-amino-3H-benzimidazol-5-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide;3-(6-amino-2-methyl-3-pyridinyl)-6-methyl-2-(3H-1,2,4-triazol-5-yl)benzenesulfonamide;3-(2-aminoquinazolin-5-yl)-6-methyl-2-(3H-1,2,4-triazol-5-yl)benzenesulfonamide;3-(2-aminoquinolin-8-yl)-6-methyl-2-(3H-1,2,4-triazol-5-yl)benzenesulfonamide;7-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)-4-(trifluoromethyl)phenyl]-1,3-benzothiazol-2-amine
CID 159608765
CID 161215069
CID 161215069
4-[1-(1,2,3-benzotriazin-4-yl)-3-cinnolin-3-yl-6-(1H-imidazol-2-yl)-4-(1H-indol-2-yl)phenazin-2-yl]-1,2,3-benzothiadiazole
CID 141110756
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]bicyclo[2.2.2]octan-1-amine;N-[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]-1-bicyclo[2.2.2]octanyl]pyrrolidine-1-sulfonamide;N-[4-(1,5,7,10,11-pentazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl)-1-bicyclo[2.2.2]octanyl]pyrrolidine-1-sulfonamide
CID 157094082
3-tert-butyl-2,5-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-1H-imidazo[4,5-b]pyridine;3-tert-butyl-2-methyl-5-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methyl-5-(3-methylsulfonylphenyl)pyrazine;3-tert-butyl-2-methyl-5-phenylpyrazine;3-tert-butyl-5-methyl-4H-pyrazolo[1,5-a]pyridin-7-one;bis(3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);3-tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-6-methyl-1,2,4-triazine;8-tert-butyl-1,6-naphthyridin-7-amine;8-tert-butyl-1,6-naphthyridine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylquinoxaline;methane;sulfur dioxide
CID 157127059
2-tert-butyl-1H-benzimidazole;2-tert-butyl-1,3-benzothiazole;2-tert-butyl-1-benzothiophene;6-tert-butyl-2,3-dihydro-1H-indole;2-tert-butyl-1H-imidazo[4,5-b]pyridine;5-tert-butyl-1H-indene;5-tert-butylindolizine;5-tert-butylisoquinoline;6-tert-butylquinoxaline;2-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazole;2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;2-tert-butyl-[1,3]thiazolo[4,5-c]pyridine;2-tert-butyl-[1,3]thiazolo[5,4-c]pyridine;2-tert-butylthieno[2,3-b]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine
CID 157379861
4-tert-butyl-1H-benzimidazole;3-tert-butyl-2,5-dimethylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methyl-5-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methyl-5-phenylpyrazine;bis(3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);3-tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-6-methyl-1,2,4-triazine;8-tert-butyl-1,6-naphthyridin-7-amine;8-tert-butyl-1,6-naphthyridine;3-tert-butylpyrazolo[1,5-a]pyrimidine;8-tert-butylquinoline;5-tert-butylquinoxaline;sulfur dioxide
CID 157539998

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline?
The IUPAC name of 2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline (CID 161149827) is 2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline.
What is the SMILES notation for 2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline?
The canonical SMILES for 2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline is CC(C)(C)c1cccc2c(N)ncnc12.CC(C)(C)c1cccc2cncnc12.CC(C)(C)c1nc2ccccc2[nH]1.CN(C)CCN(C)S(=O)(=O)c1ccccc1C(C)(C)C.CN(C)c1cccc(C(C)(C)C)c1S(N)(=O)=O.CN(c1ccccc1C(C)(C)C)S(C)(=O)=O.CN1CCN(c2cccc(C(C)(C)C)c2)CC1.Cc1cn(C)c2cccc(C(C)(C)C)c12.Cc1nn(C)c2cccc(C(C)(C)C)c12.Cn1cnc(-c2ccccc2C(C)(C)C)c1.Cn1ncc2ccc(C(C)(C)C)cc21.
What is the InChIKey of 2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline?
The InChIKey is UONKFOLKHBDSJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2S.C15H24N2.C14H18N2.C14H19N.C13H18N2.C12H15N3.C12H20N2O2S.C12H16N2.C12H14N2.C12H19NO2S.C11H14N2/c1-15(2,3)13-9-7-8-10-14(13)20(18,19)17(6)12-11-16(4)5;1-15(2,3)13-6-5-7-14(12-13)17-10-8-16(4)9-11-17;1-14(2,3)12-8-6-5-7-11(12)13-9-16(4)10-15-13;1-10-9-15(5)12-8-6-7-11(13(10)12)14(2,3)4;1-9-12-10(13(2,3)4)7-6-8-11(12)15(5)14-9;1-12(2,3)9-6-4-5-8-10(9)14-7-15-11(8)13;1-12(2,3)9-7-6-8-10(14(4)5)11(9)17(13,15)16;1-12(2,3)10-6-5-9-8-13-14(4)11(9)7-10;1-12(2,3)10-6-4-5-9-7-13-8-14-11(9)10;1-12(2,3)10-8-6-7-9-11(10)13(4)16(5,14)15;1-11(2,3)10-12-8-6-4-5-7-9(8)13-10/h7-10H,11-12H2,1-6H3;5-7,12H,8-11H2,1-4H3;5-10H,1-4H3;6-9H,1-5H3;6-8H,1-5H3;4-7H,1-3H3,(H2,13,14,15);6-8H,1-5H3,(H2,13,15,16);5-8H,1-4H3;4-8H,1-3H3;6-9H,1-5H3;4-7H,1-3H3,(H,12,13).
What are the key properties of 2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline?
2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline has a molecular weight of 2396.53 g/mol, XLogP of 30.50, 11 rotatable bonds, 3 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-1H-benzimidazole;2-tert-butyl-6-(dimethylamino)benzenesulfonamide;2-tert-butyl-N-[2-(dimethylamino)ethyl]-N-methylbenzenesulfonamide;4-tert-butyl-1,3-dimethylindazole;4-tert-butyl-1,3-dimethylindole;6-tert-butyl-1-methylindazole;4-(2-tert-butylphenyl)-1-methylimidazole;N-(2-tert-butylphenyl)-N-methylmethanesulfonamide;1-(3-tert-butylphenyl)-4-methylpiperazine;8-tert-butylquinazolin-4-amine;8-tert-butylquinazoline is sourced from PubChem (CID 161149827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).