N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one

C94H88F9N27O11S — CID 158314521

IUPACN-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one
SMILESCC(=O)c1ccc2c(c1)nc(N)n2C.CC(=O)c1ccc2c(c1)nc(NC(=S)n1ccnc1)n2C.CC(=O)c1ccc2c(c1)nc(Nc1nc3ccc(OC(F)(F)F)cc3[nH]1)n2C.CCCCC(=O)c1ccc2c(c1)nc(Nc1nc3ccc(OC(F)(F)F)cc3[nH]1)n2C.Cc1ccc(N)c(N)c1.Cc1ccc([N+](=O)[O-])c(N)c1.Cn1c(Nc2nc3ccc(OC(F)(F)F)cc3[nH]2)nc2cc(C(=O)O)ccc21
InChIInChI=1S/C21H20F3N5O2.C18H14F3N5O2.C17H12F3N5O3.C14H13N5OS.C10H11N3O.C7H8N2O2.C7H10N2/c1-3-4-5-18(30)12-6-9-17-16(10-12)27-20(29(17)2)28-19-25-14-8-7-13(11-15(14)26-19)31-21(22,23)24;1-9(27)10-3-6-15-14(7-10)24-17(26(15)2)25-16-22-12-5-4-11(8-13(12)23-16)28-18(19,20)21;1-25-13-5-2-8(14(26)27)6-12(13)23-16(25)24-15-21-10-4-3-9(7-11(10)22-15)28-17(18,19)20;1-9(20)10-3-4-12-11(7-10)16-13(18(12)2)17-14(21)19-6-5-15-8-19;1-6(14)7-3-4-9-8(5-7)12-10(11)13(9)2;1-5-2-3-7(9(10)11)6(8)4-5;1-5-2-3-6(8)7(9)4-5/h6-11H,3-5H2,1-2H3,(H2,25,26,27,28);3-8H,1-2H3,(H2,22,23,24,25);2-7H,1H3,(H,26,27)(H2,21,22,23,24);3-8H,1-2H3,(H,16,17,21);3-5H,1-2H3,(H2,11,12);2-4H,8H2,1H3;2-4H,8-9H2,1H3
InChIKeyGOCDRFPUIGIQCY-UHFFFAOYSA-N
MW1974.96 g/mol
LogP19.77
Rot. Bonds19

About N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one

N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one (PubChem CID 158314521) has the molecular formula C94H88F9N27O11S and a molecular weight of 1974.96 g/mol. Its IUPAC name is N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one.

Molecular Properties

Compound NameN-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one
PubChem CID158314521
Molecular FormulaC94H88F9N27O11S
Molecular Weight1974.96 g/mol
Exact Mass1973.67
IUPAC NameN-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one
SMILESCC(=O)c1ccc2c(c1)nc(N)n2C.CC(=O)c1ccc2c(c1)nc(NC(=S)n1ccnc1)n2C.CC(=O)c1ccc2c(c1)nc(Nc1nc3ccc(OC(F)(F)F)cc3[nH]1)n2C.CCCCC(=O)c1ccc2c(c1)nc(Nc1nc3ccc(OC(F)(F)F)cc3[nH]1)n2C.Cc1ccc(N)c(N)c1.Cc1ccc([N+](=O)[O-])c(N)c1.Cn1c(Nc2nc3ccc(OC(F)(F)F)cc3[nH]2)nc2cc(C(=O)O)ccc21
InChIInChI=1S/C21H20F3N5O2.C18H14F3N5O2.C17H12F3N5O3.C14H13N5OS.C10H11N3O.C7H8N2O2.C7H10N2/c1-3-4-5-18(30)12-6-9-17-16(10-12)27-20(29(17)2)28-19-25-14-8-7-13(11-15(14)26-19)31-21(22,23)24;1-9(27)10-3-6-15-14(7-10)24-17(26(15)2)25-16-22-12-5-4-11(8-13(12)23-16)28-18(19,20)21;1-25-13-5-2-8(14(26)27)6-12(13)23-16(25)24-15-21-10-4-3-9(7-11(10)22-15)28-17(18,19)20;1-9(20)10-3-4-12-11(7-10)16-13(18(12)2)17-14(21)19-6-5-15-8-19;1-6(14)7-3-4-9-8(5-7)12-10(11)13(9)2;1-5-2-3-7(9(10)11)6(8)4-5;1-5-2-3-6(8)7(9)4-5/h6-11H,3-5H2,1-2H3,(H2,25,26,27,28);3-8H,1-2H3,(H2,22,23,24,25);2-7H,1H3,(H,26,27)(H2,21,22,23,24);3-8H,1-2H3,(H,16,17,21);3-5H,1-2H3,(H2,11,12);2-4H,8H2,1H3;2-4H,8-9H2,1H3
InChIKeyGOCDRFPUIGIQCY-UHFFFAOYSA-N
XLogP19.77
TPSA521.57 Ų
H-Bond Donors12
H-Bond Acceptors33
Rotatable Bonds19
Heavy Atoms142
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001974.96
LogP ≤ 519.77
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1033

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one with MolForge

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Related Compounds

ethyl 2-(imidazole-1-carbothioylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 1-methyl-2-[[1-methyl-5-(trifluoromethoxy)benzimidazol-2-yl]amino]benzimidazole-5-carboxylate;methane;1-methyl-2-[[1-methyl-5-(trifluoromethoxy)benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;N-methyl-2-nitro-4-(trifluoromethoxy)aniline;1-N-methyl-4-(trifluoromethoxy)benzene-1,2-diamine;2-nitro-4-(trifluoromethoxy)aniline
CID 157144157
1'-(6-benzoyl-1H-benzimidazol-2-yl)spiro[2-benzofuran-3,4'-piperidine]-1-one;1'-(6-methyl-1H-benzimidazol-2-yl)spiro[2-benzofuran-3,4'-piperidine]-1-one;methyl 2-(3-oxospiro[2-benzofuran-1,4'-piperidine]-1'-yl)-3H-benzimidazole-5-carboxylate;1'-(6-pyrazin-2-yl-1H-benzimidazol-2-yl)spiro[2-benzofuran-3,4'-piperidine]-1-one;1'-(6-pyridin-3-yl-1H-benzimidazol-2-yl)spiro[2-benzofuran-3,4'-piperidine]-1-one;1'-[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]spiro[2-benzofuran-3,4'-piperidine]-1-one
CID 160822321
ethyl 2-amino-1-(oxan-4-yl)benzimidazole-5-carboxylate;ethyl 2-(imidazole-1-carbothioylamino)-1-(oxan-4-yl)benzimidazole-5-carboxylate;ethyl 1-(oxan-4-yl)-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylate;N-(2-methoxyethyl)-1-(oxan-4-yl)-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxamide;1-(oxan-4-yl)-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid
CID 161925466
N,1-bis(2-methoxyethyl)-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxamide;1-(2-methoxyethyl)-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid
CID 164954913
N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-methyl-2-[[1-methyl-5-(trifluoromethoxy)benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[1-methyl-5-(trifluoromethoxy)benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;N-methyl-2-nitro-4-(trifluoromethoxy)aniline;1-N-methyl-4-(trifluoromethoxy)benzene-1,2-diamine;2-nitro-4-(trifluoromethoxy)aniline
CID 164975788
ethyl 2-amino-1-methylbenzimidazole-5-carboxylate;ethyl 2-(imidazole-1-carbothioylamino)-1-methylbenzimidazole-5-carboxylate;ethyl 1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylate;N-(2-methoxyethyl)-1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxamide;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid
CID 164980477
N-[5-acetyl-1-(oxan-4-yl)benzimidazol-2-yl]imidazole-1-carbothioamide;1-[2-amino-1-(oxan-4-yl)benzimidazol-5-yl]ethanone;N-(2-methoxyethyl)-1-(oxan-4-yl)-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxamide;1-(oxan-4-yl)-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-(oxan-4-yl)-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone
CID 164987342
1-[2-amino-1-(2-methoxyethyl)benzimidazol-5-yl]ethanone;carbon dioxide;1-chloro-4-ethyl-2-nitrobenzene;ethyl 3-amino-4-(2-methoxyethylamino)benzoate;ethyl 2-(imidazole-1-carbothioylamino)-1-(2-methoxyethyl)benzimidazole-5-carboxylate;ethyl 4-(2-methoxyethylamino)-3-nitrobenzoate;ethyl 1-(2-methoxyethyl)-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]methyl]benzimidazole-5-carboxylate;1-(2-methoxyethyl)-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid
CID 176531861
N-[5-acetyl-1-(2-methoxyethyl)benzimidazol-2-yl]imidazole-1-carbothioamide;1-[2-amino-1-(2-methoxyethyl)benzimidazol-5-yl]ethanone;tris(carbon dioxide);1-chloro-4-ethyl-2-nitrobenzene;4-ethyl-1-N-(2-methoxyethyl)benzene-1,2-diamine;4-ethyl-N-(2-methoxyethyl)-2-nitroaniline;1-[1-(2-methoxyethyl)-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone
CID 176543568
(E)-3-(2,4-difluorophenyl)-N-[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]prop-2-enamide;(E)-3-(3,4-difluorophenyl)-N-[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]prop-2-enamide;2-[4-[[4-(dimethylamino)benzoyl]amino]phenyl]-3-hydroxybenzimidazole-5-carboxylic acid;4-(dimethylamino)-N-[4-[6-(dimethylamino)-1-hydroxybenzimidazol-2-yl]phenyl]benzamide;(Z)-N-[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]-3-(2-methoxyphenyl)prop-2-enamide;(E)-N-[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]-3-(2-methoxyphenyl)prop-2-enamide;(E)-N-[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]-3-(4-methoxyphenyl)prop-2-enamide;N-[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]-1-methylimidazole-2-carboxamide;N-[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]-3-(4-methylphenyl)propanamide;(E)-N-[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]-3-(4-methylphenyl)prop-2-enamide
CID 157078727
2-[4-[6-[3-(dimethylamino)propoxy]-1H-benzimidazol-2-yl]phenyl]-3H-benzimidazole-5-carboxylic acid;1-[2-[4-[6-[3-(dimethylamino)propoxy]-1H-benzimidazol-2-yl]phenyl]-3H-benzimidazol-5-yl]-4-pyrrolidin-1-ylbutan-1-one;2-pyrrolidin-1-ylethanamine
CID 157791580
(4-benzylpiperidin-1-yl)-(6-methoxy-3H-benzimidazol-5-yl)methanone;4,5-diamino-2-methoxybenzoic acid;6-methoxy-3H-benzimidazole-5-carboxylic acid;2-methoxy-4,5-dinitrobenzoic acid;2-methoxy-4-nitrobenzoic acid
CID 158479546

Frequently Asked Questions

What is the IUPAC name of N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one?
The IUPAC name of N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one (CID 158314521) is N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one.
What is the SMILES notation for N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one?
The canonical SMILES for N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one is CC(=O)c1ccc2c(c1)nc(N)n2C.CC(=O)c1ccc2c(c1)nc(NC(=S)n1ccnc1)n2C.CC(=O)c1ccc2c(c1)nc(Nc1nc3ccc(OC(F)(F)F)cc3[nH]1)n2C.CCCCC(=O)c1ccc2c(c1)nc(Nc1nc3ccc(OC(F)(F)F)cc3[nH]1)n2C.Cc1ccc(N)c(N)c1.Cc1ccc([N+](=O)[O-])c(N)c1.Cn1c(Nc2nc3ccc(OC(F)(F)F)cc3[nH]2)nc2cc(C(=O)O)ccc21.
What is the InChIKey of N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one?
The InChIKey is GOCDRFPUIGIQCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20F3N5O2.C18H14F3N5O2.C17H12F3N5O3.C14H13N5OS.C10H11N3O.C7H8N2O2.C7H10N2/c1-3-4-5-18(30)12-6-9-17-16(10-12)27-20(29(17)2)28-19-25-14-8-7-13(11-15(14)26-19)31-21(22,23)24;1-9(27)10-3-6-15-14(7-10)24-17(26(15)2)25-16-22-12-5-4-11(8-13(12)23-16)28-18(19,20)21;1-25-13-5-2-8(14(26)27)6-12(13)23-16(25)24-15-21-10-4-3-9(7-11(10)22-15)28-17(18,19)20;1-9(20)10-3-4-12-11(7-10)16-13(18(12)2)17-14(21)19-6-5-15-8-19;1-6(14)7-3-4-9-8(5-7)12-10(11)13(9)2;1-5-2-3-7(9(10)11)6(8)4-5;1-5-2-3-6(8)7(9)4-5/h6-11H,3-5H2,1-2H3,(H2,25,26,27,28);3-8H,1-2H3,(H2,22,23,24,25);2-7H,1H3,(H,26,27)(H2,21,22,23,24);3-8H,1-2H3,(H,16,17,21);3-5H,1-2H3,(H2,11,12);2-4H,8H2,1H3;2-4H,8-9H2,1H3.
What are the key properties of N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one?
N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one has a molecular weight of 1974.96 g/mol, XLogP of 19.77, 19 rotatable bonds, 12 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetyl-1-methylbenzimidazol-2-yl)imidazole-1-carbothioamide;1-(2-amino-1-methylbenzimidazol-5-yl)ethanone;4-methylbenzene-1,2-diamine;5-methyl-2-nitroaniline;1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazole-5-carboxylic acid;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]ethanone;1-[1-methyl-2-[[6-(trifluoromethoxy)-1H-benzimidazol-2-yl]amino]benzimidazol-5-yl]pentan-1-one is sourced from PubChem (CID 158314521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).