2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole

C115H107F2IN40O5S6 — CID 159368030

IUPAC2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole
SMILESC=C(OC)c1cccc(CSc2nc3ccccc3n2-c2ncccc2C)n1.CCOc1ccnc(CSc2nc3ccccc3n2-c2nnnn2C)c1C.CCc1ccnc(CSc2nc3ccccc3n2-c2nnnn2C)c1.Cn1nnnc1-n1c(SCc2cccc(CC(=O)COc3ccccc3)n2)nc2ccc(F)cc21.Cn1nnnc1-n1c(SCc2cccc(NC(=O)C(C)(C)F)n2)nc2ccc(I)cc21.Cn1nnnc1-n1c(SCc2ccccn2)nc2ccccc21
InChIInChI=1S/C24H20FN7O2S.C22H20N4OS.C19H18FIN8OS.C18H19N7OS.C17H17N7S.C15H13N7S/c1-31-23(28-29-30-31)32-22-12-16(25)10-11-21(22)27-24(32)35-15-18-7-5-6-17(26-18)13-19(33)14-34-20-8-3-2-4-9-20;1-15-8-7-13-23-21(15)26-20-12-5-4-10-19(20)25-22(26)28-14-17-9-6-11-18(24-17)16(2)27-3;1-19(2,20)16(30)24-15-6-4-5-12(22-15)10-31-18-23-13-8-7-11(21)9-14(13)29(18)17-25-26-27-28(17)3;1-4-26-16-9-10-19-14(12(16)2)11-27-18-20-13-7-5-6-8-15(13)25(18)17-21-22-23-24(17)3;1-3-12-8-9-18-13(10-12)11-25-17-19-14-6-4-5-7-15(14)24(17)16-20-21-22-23(16)2;1-21-14(18-19-20-21)22-13-8-3-2-7-12(13)17-15(22)23-10-11-6-4-5-9-16-11/h2-12H,13-15H2,1H3;4-13H,2,14H2,1,3H3;4-9H,10H2,1-3H3,(H,22,24,30);5-10H,4,11H2,1-3H3;4-10H,3,11H2,1-2H3;2-9H,10H2,1H3
InChIKeyLJJMJTGKRCKXMT-UHFFFAOYSA-N
MW2486.70 g/mol
LogP20.11
Rot. Bonds36

About 2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole

2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole (PubChem CID 159368030) has the molecular formula C115H107F2IN40O5S6 and a molecular weight of 2486.70 g/mol. Its IUPAC name is 2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole.

Molecular Properties

Compound Name2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole
PubChem CID159368030
Molecular FormulaC115H107F2IN40O5S6
Molecular Weight2486.70 g/mol
Exact Mass2484.67
IUPAC Name2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole
SMILESC=C(OC)c1cccc(CSc2nc3ccccc3n2-c2ncccc2C)n1.CCOc1ccnc(CSc2nc3ccccc3n2-c2nnnn2C)c1C.CCc1ccnc(CSc2nc3ccccc3n2-c2nnnn2C)c1.Cn1nnnc1-n1c(SCc2cccc(CC(=O)COc3ccccc3)n2)nc2ccc(F)cc21.Cn1nnnc1-n1c(SCc2cccc(NC(=O)C(C)(C)F)n2)nc2ccc(I)cc21.Cn1nnnc1-n1c(SCc2ccccn2)nc2ccccc21
InChIInChI=1S/C24H20FN7O2S.C22H20N4OS.C19H18FIN8OS.C18H19N7OS.C17H17N7S.C15H13N7S/c1-31-23(28-29-30-31)32-22-12-16(25)10-11-21(22)27-24(32)35-15-18-7-5-6-17(26-18)13-19(33)14-34-20-8-3-2-4-9-20;1-15-8-7-13-23-21(15)26-20-12-5-4-10-19(20)25-22(26)28-14-17-9-6-11-18(24-17)16(2)27-3;1-19(2,20)16(30)24-15-6-4-5-12(22-15)10-31-18-23-13-8-7-11(21)9-14(13)29(18)17-25-26-27-28(17)3;1-4-26-16-9-10-19-14(12(16)2)11-27-18-20-13-7-5-6-8-15(13)25(18)17-21-22-23-24(17)3;1-3-12-8-9-18-13(10-12)11-25-17-19-14-6-4-5-7-15(14)24(17)16-20-21-22-23(16)2;1-21-14(18-19-20-21)22-13-8-3-2-7-12(13)17-15(22)23-10-11-6-4-5-9-16-11/h2-12H,13-15H2,1H3;4-13H,2,14H2,1,3H3;4-9H,10H2,1-3H3,(H,22,24,30);5-10H,4,11H2,1-3H3;4-10H,3,11H2,1-2H3;2-9H,10H2,1H3
InChIKeyLJJMJTGKRCKXMT-UHFFFAOYSA-N
XLogP20.11
TPSA489.01 Ų
H-Bond Donors1
H-Bond Acceptors50
Rotatable Bonds36
Heavy Atoms169
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002486.70
LogP ≤ 520.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1050

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole with MolForge

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Launch Full Analysis

Related Compounds

2,2-difluoro-N-[6-[[6-[2-[[6-[2-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-1,3-thiazol-5-yl]-1-(1-methylimidazol-2-yl)benzimidazol-2-yl]sulfanylmethyl]pyridin-4-yl]-1-(1-methylimidazol-2-yl)benzimidazol-2-yl]sulfanylmethyl]pyridin-2-yl]-2-phenoxyacetamide
CID 142401357
2,2-difluoro-N-[6-[[1-(3-methyl-2-pyridinyl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]-2-phenoxyacetamide;2,2-difluoro-N-[6-[(5-phenylpyrrolo[3,2-d]triazin-6-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(7-phenylpyrrolo[2,3-d]triazin-6-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[(5-phenylpyrrolo[3,2-d]triazin-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[4-[(7-phenylpyrrolo[2,3-d]triazin-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]acetamide
CID 159324249
butyl 2-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]acetate;N-[6-[[1-(5-chloropyrimidin-4-yl)indol-2-yl]oxymethyl]-2-pyridinyl]-2,2-difluoro-2-phenoxyacetamide;2-fluoro-N-[6-[[1-(3-methyl-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]oxymethyl]-2-pyridinyl]-2-phenoxypropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-(4-methylphenoxy)-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]acetamide
CID 162029389
tert-butyl 2-[6-[[4,6-difluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]acetate;tert-butyl 2-[6-[[1-(1-methylimidazol-2-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]acetate;tert-butyl 2-[6-[[1-(3-methylpyrazin-2-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]acetate;2-fluoro-N-[6-[[5-isocyano-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]-2-phenoxypropanamide;2-fluoro-N-[6-[[6-isocyano-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]-2-phenoxypropanamide
CID 157609937
N-[6-[[4,6-difluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]-2-fluoro-2-phenoxypropanamide;2-fluoro-N-[6-[[1-(1-methylimidazol-2-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]-2-phenoxypropanamide;2-fluoro-N-[6-[[1-(3-methylpyrazin-2-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]-2-phenoxypropanamide;2-[methyl(methylidene)-lambda4-sulfanyl]-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]acetamide;2-(methyl-methylidene-oxo-lambda6-sulfanyl)-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]acetamide
CID 158510681
2-[(4-ethyl-3-methoxy-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[[4-(4-methoxybutyl)-3-methyl-2-pyridinyl]methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;1-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]butan-2-one;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]cyclopropanecarboxamide
CID 158658821

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole?
The IUPAC name of 2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole (CID 159368030) is 2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole.
What is the SMILES notation for 2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole?
The canonical SMILES for 2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole is C=C(OC)c1cccc(CSc2nc3ccccc3n2-c2ncccc2C)n1.CCOc1ccnc(CSc2nc3ccccc3n2-c2nnnn2C)c1C.CCc1ccnc(CSc2nc3ccccc3n2-c2nnnn2C)c1.Cn1nnnc1-n1c(SCc2cccc(CC(=O)COc3ccccc3)n2)nc2ccc(F)cc21.Cn1nnnc1-n1c(SCc2cccc(NC(=O)C(C)(C)F)n2)nc2ccc(I)cc21.Cn1nnnc1-n1c(SCc2ccccn2)nc2ccccc21.
What is the InChIKey of 2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole?
The InChIKey is LJJMJTGKRCKXMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20FN7O2S.C22H20N4OS.C19H18FIN8OS.C18H19N7OS.C17H17N7S.C15H13N7S/c1-31-23(28-29-30-31)32-22-12-16(25)10-11-21(22)27-24(32)35-15-18-7-5-6-17(26-18)13-19(33)14-34-20-8-3-2-4-9-20;1-15-8-7-13-23-21(15)26-20-12-5-4-10-19(20)25-22(26)28-14-17-9-6-11-18(24-17)16(2)27-3;1-19(2,20)16(30)24-15-6-4-5-12(22-15)10-31-18-23-13-8-7-11(21)9-14(13)29(18)17-25-26-27-28(17)3;1-4-26-16-9-10-19-14(12(16)2)11-27-18-20-13-7-5-6-8-15(13)25(18)17-21-22-23-24(17)3;1-3-12-8-9-18-13(10-12)11-25-17-19-14-6-4-5-7-15(14)24(17)16-20-21-22-23(16)2;1-21-14(18-19-20-21)22-13-8-3-2-7-12(13)17-15(22)23-10-11-6-4-5-9-16-11/h2-12H,13-15H2,1H3;4-13H,2,14H2,1,3H3;4-9H,10H2,1-3H3,(H,22,24,30);5-10H,4,11H2,1-3H3;4-10H,3,11H2,1-2H3;2-9H,10H2,1H3.
What are the key properties of 2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole?
2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole has a molecular weight of 2486.70 g/mol, XLogP of 20.11, 36 rotatable bonds, 1 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-[(4-ethyl-2-pyridinyl)methylsulfanyl]-1-(1-methyltetrazol-5-yl)benzimidazole;2-fluoro-N-[6-[[6-iodo-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-2-methylpropanamide;1-[6-[[6-fluoro-1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]sulfanylmethyl]-2-pyridinyl]-3-phenoxypropan-2-one;2-[[6-(1-methoxyethenyl)-2-pyridinyl]methylsulfanyl]-1-(3-methyl-2-pyridinyl)benzimidazole;1-(1-methyltetrazol-5-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole is sourced from PubChem (CID 159368030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).