1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate

C121H146N22O17S5 — CID 160561420

IUPAC1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate
SMILESCC(=O)NCCCn1c(NC(=O)c2cccs2)nc2cc(C(=O)N(C)C3CCCCC3)ccc21.CC(=O)OCCCn1c(NC(=O)c2cccs2)nc2cc(C(=O)N(C)C3CCCCC3)ccc21.CN(C(=O)c1ccc2c(c1)nc(NC(=O)c1cccs1)n2CCCCCC(=O)O)C1CCCCC1.CN(C(=O)c1ccc2c(c1)nc(NC(=O)c1cccs1)n2CCO)C1CCCCC1.CN(C(=O)c1ccc2nc(NC(=O)c3cccs3)n(CCC(N)=O)c2c1)C1CCCCC1
InChIInChI=1S/C26H32N4O4S.C25H31N5O3S.C25H30N4O4S.C23H27N5O3S.C22H26N4O3S/c1-29(19-9-4-2-5-10-19)25(34)18-13-14-21-20(17-18)27-26(28-24(33)22-11-8-16-35-22)30(21)15-7-3-6-12-23(31)32;1-17(31)26-13-7-14-30-21-12-11-18(24(33)29(2)19-8-4-3-5-9-19)16-20(21)27-25(30)28-23(32)22-10-6-15-34-22;1-17(30)33-14-7-13-29-21-12-11-18(24(32)28(2)19-8-4-3-5-9-19)16-20(21)26-25(29)27-23(31)22-10-6-15-34-22;1-27(16-6-3-2-4-7-16)22(31)15-9-10-17-18(14-15)28(12-11-20(24)29)23(25-17)26-21(30)19-8-5-13-32-19;1-25(16-6-3-2-4-7-16)21(29)15-9-10-18-17(14-15)23-22(26(18)11-12-27)24-20(28)19-8-5-13-30-19/h8,11,13-14,16-17,19H,2-7,9-10,12,15H2,1H3,(H,31,32)(H,27,28,33);6,10-12,15-16,19H,3-5,7-9,13-14H2,1-2H3,(H,26,31)(H,27,28,32);6,10-12,15-16,19H,3-5,7-9,13-14H2,1-2H3,(H,26,27,31);5,8-10,13-14,16H,2-4,6-7,11-12H2,1H3,(H2,24,29)(H,25,26,30);5,8-10,13-14,16,27H,2-4,6-7,11-12H2,1H3,(H,23,24,28)
InChIKeyQZJANRIAHSAMNU-UHFFFAOYSA-N
MW2340.97 g/mol
LogP21.77
Rot. Bonds39

About 1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate

1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate (PubChem CID 160561420) has the molecular formula C121H146N22O17S5 and a molecular weight of 2340.97 g/mol. Its IUPAC name is 1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate.

Molecular Properties

Compound Name1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate
PubChem CID160561420
Molecular FormulaC121H146N22O17S5
Molecular Weight2340.97 g/mol
Exact Mass2338.98
IUPAC Name1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate
SMILESCC(=O)NCCCn1c(NC(=O)c2cccs2)nc2cc(C(=O)N(C)C3CCCCC3)ccc21.CC(=O)OCCCn1c(NC(=O)c2cccs2)nc2cc(C(=O)N(C)C3CCCCC3)ccc21.CN(C(=O)c1ccc2c(c1)nc(NC(=O)c1cccs1)n2CCCCCC(=O)O)C1CCCCC1.CN(C(=O)c1ccc2c(c1)nc(NC(=O)c1cccs1)n2CCO)C1CCCCC1.CN(C(=O)c1ccc2nc(NC(=O)c3cccs3)n(CCC(N)=O)c2c1)C1CCCCC1
InChIInChI=1S/C26H32N4O4S.C25H31N5O3S.C25H30N4O4S.C23H27N5O3S.C22H26N4O3S/c1-29(19-9-4-2-5-10-19)25(34)18-13-14-21-20(17-18)27-26(28-24(33)22-11-8-16-35-22)30(21)15-7-3-6-12-23(31)32;1-17(31)26-13-7-14-30-21-12-11-18(24(33)29(2)19-8-4-3-5-9-19)16-20(21)27-25(30)28-23(32)22-10-6-15-34-22;1-17(30)33-14-7-13-29-21-12-11-18(24(32)28(2)19-8-4-3-5-9-19)16-20(21)26-25(29)27-23(31)22-10-6-15-34-22;1-27(16-6-3-2-4-7-16)22(31)15-9-10-17-18(14-15)28(12-11-20(24)29)23(25-17)26-21(30)19-8-5-13-32-19;1-25(16-6-3-2-4-7-16)21(29)15-9-10-18-17(14-15)23-22(26(18)11-12-27)24-20(28)19-8-5-13-30-19/h8,11,13-14,16-17,19H,2-7,9-10,12,15H2,1H3,(H,31,32)(H,27,28,33);6,10-12,15-16,19H,3-5,7-9,13-14H2,1-2H3,(H,26,31)(H,27,28,32);6,10-12,15-16,19H,3-5,7-9,13-14H2,1-2H3,(H,26,27,31);5,8-10,13-14,16H,2-4,6-7,11-12H2,1H3,(H2,24,29)(H,25,26,30);5,8-10,13-14,16,27H,2-4,6-7,11-12H2,1H3,(H,23,24,28)
InChIKeyQZJANRIAHSAMNU-UHFFFAOYSA-N
XLogP21.77
TPSA492.17 Ų
H-Bond Donors9
H-Bond Acceptors31
Rotatable Bonds39
Heavy Atoms165
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002340.97
LogP ≤ 521.77
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate with MolForge

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Related Compounds

ethyl 3-(5-(cyclohexyl(methyl)carbamoyl)-2-(thiophene-2-carboxamido)-1H-benzo[d]imidazol-1-yl)propanoate
CID 10162990
N-[1-(3-amino-3-oxopropyl)-5-[methyl-(2,2,2-trifluoroacetyl)amino]benzimidazol-2-yl]thiophene-2-carboxamide;tert-butyl 3-[5-[benzoyl(methyl)amino]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propanoate;tert-butyl 3-[5-[cyclopentanecarbonyl(methyl)amino]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propanoate;N-[1-[(4-carbamoylcyclohexyl)methyl]-5-[cyclohexanecarbonyl(methyl)amino]benzimidazol-2-yl]thiophene-2-carboxamide
CID 157156683
1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6S)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide;1-ethyl-N-[(1R)-1-(4-ethylsulfonylphenyl)-2-hydroxyethyl]-2-[[(3S,6R)-6-(trifluoromethyl)oxan-3-yl]methyl]benzimidazole-5-carboxamide
CID 157219122
6-[5-[Cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid
CID 10117609
Methyl 6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoate
CID 10118382
N-(3-hydroxy-1-thiophen-3-ylpropyl)-1-pentan-3-yl-2-(thiophen-2-ylmethyl)benzimidazole-5-carboxamide
CID 90087588
methyl 2-(3-butyl-2-oxo-1H-benzimidazol-4-yl)-1-(2-methylpropyl)benzimidazole-5-carboxylate;methyl 1-butyl-2-[2-oxo-3-(2-phenylethyl)-1H-benzimidazol-4-yl]benzimidazole-5-carboxylate;methyl 1-butyl-2-[2-oxo-3-(thiophen-2-ylmethyl)-1H-benzimidazol-4-yl]benzimidazole-5-carboxylate;methyl 2-(3-butylspiro[1H-benzimidazole-2,1'-cyclopentane]-4-yl)-1-(2-methylpropyl)benzimidazole-5-carboxylate;methyl 1-cyclopentyl-2-[3-(2-methoxyethyl)-2-oxo-1H-benzimidazol-4-yl]benzimidazole-5-carboxylate;methyl 1-(2-methoxyethyl)-2-[2-oxo-3-(thiophen-2-ylmethyl)-1H-benzimidazol-4-yl]benzimidazole-5-carboxylate;methyl 2-[3-(3-methoxypropyl)-2-oxo-1H-benzimidazol-4-yl]-1-(3-methylbutyl)benzimidazole-5-carboxylate;methyl 1-(3-methylbutyl)-2-[2-oxo-1-[(E)-3-phenylprop-2-enyl]-3-propan-2-ylbenzimidazol-4-yl]benzimidazole-5-carboxylate
CID 157504306
2-aminoethanol;3-amino-4-(2-hydroxyethylamino)benzoic acid;2-[5-[(2-amino-5-thiophen-2-ylphenyl)carbamoyl]-2-methylbenzimidazol-1-yl]ethyl acetate;N-(2-amino-5-thiophen-2-ylphenyl)-1-(2-hydroxyethyl)-2-methylbenzimidazole-5-carboxamide;5-(2,3-dihydrothiophen-2-yl)-2-nitroaniline;1-[2-(1-ethoxyethenoxy)ethyl]-2-methylbenzimidazole-5-carboxylic acid;4-fluoro-3-nitrobenzoic acid;4-(2-hydroxyethylamino)-3-nitrobenzoic acid;1-(2-hydroxyethyl)-2-methylbenzimidazole-5-carboxylic acid;2-[2-methyl-5-[(2-nitro-5-thiophen-2-ylphenyl)carbamoyl]benzimidazol-1-yl]ethyl acetate
CID 157547887
3-amino-N-cyclohexyl-4-(3-hydroxypropylamino)-N-methylbenzamide;2-amino-N-cyclohexyl-1-(3-hydroxypropyl)-N-methylbenzimidazole-5-carboxamide;butan-1-amine;N-cyclohexyl-4-fluoro-N-methyl-3-nitrobenzamide;N-cyclohexyl-4-(3-hydroxypropylamino)-N-methyl-3-nitrobenzamide;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl thiophene-2-carboxylate;thiophene-2-carbonyl chloride
CID 157734406
(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-N-[[5-[(2-methylbenzimidazol-1-yl)methyl]thiophen-3-yl]methyl]-4-oxobutanamide;[(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-3-methyl-1-[5-[(2-methylbenzimidazol-1-yl)methyl]thiophen-3-yl]-1,4-dioxobutan-2-yl] acetate
CID 157746516
N-cyclohexyl-1-(4-hydroxybutyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(5-hydroxypentyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(3-methoxypropyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;methyl 6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoate
CID 157769870
3-amino-N-cyclohexyl-4-(3-hydroxypropylamino)-N-methylbenzamide;2-amino-N-cyclohexyl-1-(3-hydroxypropyl)-N-methylbenzimidazole-5-carboxamide;N-cyclohexyl-4-fluoro-N-methyl-3-nitrobenzamide;N-cyclohexyl-4-(3-hydroxypropylamino)-N-methyl-3-nitrobenzamide;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl thiophene-2-carboxylate;ethyl 4-aminobutanoate;thiophene-2-carbonyl chloride
CID 158095244

Frequently Asked Questions

What is the IUPAC name of 1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate?
The IUPAC name of 1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate (CID 160561420) is 1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate.
What is the SMILES notation for 1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate?
The canonical SMILES for 1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate is CC(=O)NCCCn1c(NC(=O)c2cccs2)nc2cc(C(=O)N(C)C3CCCCC3)ccc21.CC(=O)OCCCn1c(NC(=O)c2cccs2)nc2cc(C(=O)N(C)C3CCCCC3)ccc21.CN(C(=O)c1ccc2c(c1)nc(NC(=O)c1cccs1)n2CCCCCC(=O)O)C1CCCCC1.CN(C(=O)c1ccc2c(c1)nc(NC(=O)c1cccs1)n2CCO)C1CCCCC1.CN(C(=O)c1ccc2nc(NC(=O)c3cccs3)n(CCC(N)=O)c2c1)C1CCCCC1.
What is the InChIKey of 1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate?
The InChIKey is QZJANRIAHSAMNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32N4O4S.C25H31N5O3S.C25H30N4O4S.C23H27N5O3S.C22H26N4O3S/c1-29(19-9-4-2-5-10-19)25(34)18-13-14-21-20(17-18)27-26(28-24(33)22-11-8-16-35-22)30(21)15-7-3-6-12-23(31)32;1-17(31)26-13-7-14-30-21-12-11-18(24(33)29(2)19-8-4-3-5-9-19)16-20(21)27-25(30)28-23(32)22-10-6-15-34-22;1-17(30)33-14-7-13-29-21-12-11-18(24(32)28(2)19-8-4-3-5-9-19)16-20(21)26-25(29)27-23(31)22-10-6-15-34-22;1-27(16-6-3-2-4-7-16)22(31)15-9-10-17-18(14-15)28(12-11-20(24)29)23(25-17)26-21(30)19-8-5-13-32-19;1-25(16-6-3-2-4-7-16)21(29)15-9-10-18-17(14-15)23-22(26(18)11-12-27)24-20(28)19-8-5-13-30-19/h8,11,13-14,16-17,19H,2-7,9-10,12,15H2,1H3,(H,31,32)(H,27,28,33);6,10-12,15-16,19H,3-5,7-9,13-14H2,1-2H3,(H,26,31)(H,27,28,32);6,10-12,15-16,19H,3-5,7-9,13-14H2,1-2H3,(H,26,27,31);5,8-10,13-14,16H,2-4,6-7,11-12H2,1H3,(H2,24,29)(H,25,26,30);5,8-10,13-14,16,27H,2-4,6-7,11-12H2,1H3,(H,23,24,28).
What are the key properties of 1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate?
1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate has a molecular weight of 2340.97 g/mol, XLogP of 21.77, 39 rotatable bonds, 9 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-acetamidopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;3-(3-amino-3-oxopropyl)-N-cyclohexyl-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;N-cyclohexyl-1-(2-hydroxyethyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide;6-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]hexanoic acid;3-[5-[cyclohexyl(methyl)carbamoyl]-2-(thiophene-2-carbonylamino)benzimidazol-1-yl]propyl acetate is sourced from PubChem (CID 160561420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).