1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one

C223H172N36O26S10 — CID 158459312

IUPAC1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one
SMILESO=C1CNc2ccccc21.O=C1CNc2cccnc21.O=C1CNc2ccncc21.O=C1CNc2cnccc21.O=C1CNc2cnccc21.O=C1CNc2ncccc21.O=C1COc2ccccc21.O=C1COc2cccnc21.O=C1COc2ccncc21.O=C1COc2cnccc21.O=C1COc2ncccc21.O=C1CSc2ccccc21.O=C1CSc2cccnc21.O=C1CSc2ccncc21.O=C1CSc2cnccc21.O=C1CSc2ncccc21.c1cc2[nH]ccc2cn1.c1cc2cc[nH]c2cn1.c1cc2ccoc2cn1.c1cc2ccsc2cn1.c1cc2occc2cn1.c1cc2sccc2cn1.c1ccc2[nH]ccc2c1.c1ccc2occc2c1.c1ccc2sccc2c1.c1cnc2[nH]ccc2c1.c1cnc2cc[nH]c2c1.c1cnc2ccoc2c1.c1cnc2ccsc2c1.c1cnc2occc2c1.c1cnc2sccc2c1
InChIInChI=1S/C8H7NO.C8H7N.C8H6O2.C8H6OS.C8H6O.C8H6S.5C7H6N2O.4C7H6N2.4C7H5NO2.4C7H5NOS.4C7H5NO.4C7H5NS/c10-8-5-9-7-4-2-1-3-6(7)8;1-2-4-8-7(3-1)5-6-9-8;2*9-7-5-10-8-4-2-1-3-6(7)8;2*1-2-4-8-7(3-1)5-6-9-8;10-7-4-9-6-1-2-8-3-5(6)7;2*10-7-4-9-6-3-8-2-1-5(6)7;10-6-4-9-5-2-1-3-8-7(5)6;10-6-4-9-7-5(6)2-1-3-8-7;1-4-9-7-2-3-8-5-6(1)7;1-3-8-5-7-6(1)2-4-9-7;1-2-6-7(8-4-1)3-5-9-6;1-2-6-3-5-9-7(6)8-4-1;9-6-4-10-7-1-2-8-3-5(6)7;9-6-4-10-7-3-8-2-1-5(6)7;9-5-4-10-6-2-1-3-8-7(5)6;9-6-4-10-7-5(6)2-1-3-8-7;9-6-4-10-7-1-2-8-3-5(6)7;9-6-4-10-7-3-8-2-1-5(6)7;9-5-4-10-6-2-1-3-8-7(5)6;9-6-4-10-7-5(6)2-1-3-8-7;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-2-7-6(8-4-1)3-5-9-7;1-2-6-3-5-9-7(6)8-4-1;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-2-7-6(8-4-1)3-5-9-7;1-2-6-3-5-9-7(6)8-4-1/h1-4,9H,5H2;1-6,9H;2*1-4H,5H2;2*1-6H;4*1-3,9H,4H2;1-3H,4H2,(H,8,9);3*1-5,9H;1-5H,(H,8,9);8*1-3H,4H2;8*1-5H
InChIKeyHEYWWTMGNODVFK-UHFFFAOYSA-N
MW4092.72 g/mol
LogP46.34
Rot. Bonds

About 1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one

1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one (PubChem CID 158459312) has the molecular formula C223H172N36O26S10 and a molecular weight of 4092.72 g/mol. Its IUPAC name is 1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one.

Molecular Properties

Compound Name1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one
PubChem CID158459312
Molecular FormulaC223H172N36O26S10
Molecular Weight4092.72 g/mol
Exact Mass4089.05
IUPAC Name1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one
SMILESO=C1CNc2ccccc21.O=C1CNc2cccnc21.O=C1CNc2ccncc21.O=C1CNc2cnccc21.O=C1CNc2cnccc21.O=C1CNc2ncccc21.O=C1COc2ccccc21.O=C1COc2cccnc21.O=C1COc2ccncc21.O=C1COc2cnccc21.O=C1COc2ncccc21.O=C1CSc2ccccc21.O=C1CSc2cccnc21.O=C1CSc2ccncc21.O=C1CSc2cnccc21.O=C1CSc2ncccc21.c1cc2[nH]ccc2cn1.c1cc2cc[nH]c2cn1.c1cc2ccoc2cn1.c1cc2ccsc2cn1.c1cc2occc2cn1.c1cc2sccc2cn1.c1ccc2[nH]ccc2c1.c1ccc2occc2c1.c1ccc2sccc2c1.c1cnc2[nH]ccc2c1.c1cnc2cc[nH]c2c1.c1cnc2ccoc2c1.c1cnc2ccsc2c1.c1cnc2occc2c1.c1cnc2sccc2c1
InChIInChI=1S/C8H7NO.C8H7N.C8H6O2.C8H6OS.C8H6O.C8H6S.5C7H6N2O.4C7H6N2.4C7H5NO2.4C7H5NOS.4C7H5NO.4C7H5NS/c10-8-5-9-7-4-2-1-3-6(7)8;1-2-4-8-7(3-1)5-6-9-8;2*9-7-5-10-8-4-2-1-3-6(7)8;2*1-2-4-8-7(3-1)5-6-9-8;10-7-4-9-6-1-2-8-3-5(6)7;2*10-7-4-9-6-3-8-2-1-5(6)7;10-6-4-9-5-2-1-3-8-7(5)6;10-6-4-9-7-5(6)2-1-3-8-7;1-4-9-7-2-3-8-5-6(1)7;1-3-8-5-7-6(1)2-4-9-7;1-2-6-7(8-4-1)3-5-9-6;1-2-6-3-5-9-7(6)8-4-1;9-6-4-10-7-1-2-8-3-5(6)7;9-6-4-10-7-3-8-2-1-5(6)7;9-5-4-10-6-2-1-3-8-7(5)6;9-6-4-10-7-5(6)2-1-3-8-7;9-6-4-10-7-1-2-8-3-5(6)7;9-6-4-10-7-3-8-2-1-5(6)7;9-5-4-10-6-2-1-3-8-7(5)6;9-6-4-10-7-5(6)2-1-3-8-7;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-2-7-6(8-4-1)3-5-9-7;1-2-6-3-5-9-7(6)8-4-1;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-2-7-6(8-4-1)3-5-9-7;1-2-6-3-5-9-7(6)8-4-1/h1-4,9H,5H2;1-6,9H;2*1-4H,5H2;2*1-6H;4*1-3,9H,4H2;1-3H,4H2,(H,8,9);3*1-5,9H;1-5H,(H,8,9);8*1-3H,4H2;8*1-5H
InChIKeyHEYWWTMGNODVFK-UHFFFAOYSA-N
XLogP46.34
TPSA858.35 Ų
H-Bond Donors11
H-Bond Acceptors67
Rotatable Bonds
Heavy Atoms295
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004092.72
LogP ≤ 546.34
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1067

Analyze 1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one with MolForge

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Related Compounds

2,4-dimethylfuro[3,2-c]pyridine;1,2-dimethylimidazole;1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;1,4-dimethylindole;2,4-dimethyl-1,3-oxazole;2,4-dimethyl-1H-pyrrolo[3,2-c]pyridine;1-methylbenzotriazole;4-methylfuro[3,2-c]pyridine;7-methylfuro[2,3-c]pyridine;2-methyl-1H-imidazole;4-methyl-1H-indazole;1-methylisoquinoline;2-methyl-3-prop-1-enylpyridine;4-methylthieno[2,3-d]pyrimidine;4-methyl-6-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine
CID 157451853
4-[2-(2,4,6,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrol-5-ylmethyl)-5-(6-fluoro-1H-indol-4-yl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine;2-[4-[[2-(2-cyano-1H-indol-3-yl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl]piperazin-1-yl]-2-methylpropanamide;2-[[4-(3,3-difluoroazetidin-1-yl)piperidin-1-yl]methyl]-5-(5-fluoro-1H-indol-4-yl)-7-morpholin-4-yl-[1,3]oxazolo[4,5-d]pyrimidine;2-methyl-2-[4-[[5-(2-methyl-1-benzofuran-3-yl)-7-morpholin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]methyl]piperazin-1-yl]propanamide
CID 157947850
benzo[b][1,6]naphthyridine;1,3-benzothiazole;1-benzothiophene;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;1H-imidazole;1H-indazole;2-methyl-1H-imidazole;bis(1-methylindazole);2-methylpyrimidine;1-methylpyrrolo[2,3-c]pyridine;1,2-oxazole;1,3-oxazole;1-propylpyrazole;pyrazine;1H-pyrazole;pyridazine;pyridine;pyrimidine;1H-pyrrole;5H-pyrrolo[1,2-a]imidazole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;1,2-thiazole;1,3-thiazole;thieno[2,3-b]pyridine;thieno[3,2-b]thiophene;bis(thieno[2,3-c]pyridine);thiophene;1,3,5-triazine;5-(trifluoromethyl)-1H-pyrazole
CID 158113572
benzo[b][1,6]naphthyridine;1,3-benzothiazole;1-benzothiophene;5-(1,1-difluoroethyl)-1H-pyrazole;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;1H-indazole;5-methyl-4H-imidazole;bis(1-methylindazole);2-methylpyrimidine;1-methylpyrrolo[2,3-c]pyridine;1,2-oxazole;1,3-oxazole;1-propylpyrazole;pyrazine;1H-pyrazole;pyridazine;pyridine;bis(pyrimidine);1H-pyrrole;5H-pyrrolo[1,2-a]imidazole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1,2-thiazole;1,3-thiazole;thieno[2,3-b]pyridine;thieno[3,2-b]thiophene;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thiophene;1,3,5-triazine
CID 160409071
1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide
CID 161086765
benzo[b][1,6]naphthyridine;1,3-benzothiazole;1-benzothiophene;5-(1,1-difluoroethyl)-1H-pyrazole;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;1H-imidazole;1H-indazole;5-methyl-4H-imidazole;bis(1-methylindazole);2-methylpyrimidine;1-methylpyrrolo[2,3-c]pyridine;1,2-oxazole;1,3-oxazole;1-propylpyrazole;pyrazine;1H-pyrazole;pyridazine;pyridine;bis(pyrimidine);1H-pyrrole;5H-pyrrolo[1,2-a]imidazole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;1,2-thiazole;1,3-thiazole;thieno[2,3-b]pyridine;thieno[3,2-b]thiophene;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thiophene;1,3,5-triazine
CID 161372099
benzo[b][1,6]naphthyridine;1,3-benzothiazole;1-benzothiophene;5-(1,1-difluoroethyl)-1H-pyrazole;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;1H-imidazole;1H-indazole;2-methyl-1H-imidazole;bis(1-methylindazole);2-methylpyrimidine;1-methylpyrrolo[2,3-c]pyridine;1,2-oxazole;1,3-oxazole;1-propylpyrazole;pyrazine;1H-pyrazole;pyridazine;pyridine;pyrimidine;1H-pyrrole;5H-pyrrolo[1,2-a]imidazole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;1,2-thiazole;1,3-thiazole;thieno[2,3-b]pyridine;thieno[3,2-b]thiophene;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thiophene;1,3,5-triazine
CID 161651793
N-[3-[[4-(1-benzofuran-2-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]phenyl]-3-(trifluoromethyl)benzamide;N-[3-[[4-(1-benzothiophen-2-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]phenyl]-3-(trifluoromethyl)benzamide;N-[3-[[4-(furan-2-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]phenyl]-3-(trifluoromethyl)benzamide;N-[3-[(4-thiophen-2-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]phenyl]-3-(trifluoromethyl)benzamide
CID 161678402
1,3-benzothiazole;1-benzothiophene;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;1H-imidazole;1H-indazole;2-methyl-1H-imidazole;bis(1-methylindazole);2-methylpyrimidine;1-methylpyrrolo[2,3-c]pyridine;1-methyl-5-(trifluoromethyl)pyrazole;1,2-oxazole;1,3-oxazole;1-propylpyrazole;pyrazine;1H-pyrazole;pyridazine;pyridine;pyrido[4,3-b][1,6]naphthyridine;bis(pyrimidine);1H-pyrrole;5H-pyrrolo[1,2-a]imidazole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;1,2-thiazole;1,3-thiazole;thieno[2,3-b]pyridine;thieno[3,2-b]thiophene;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thiophene;1,3,5-triazine;5-(trifluoromethyl)-1H-pyrazole
CID 161693883
bis(1H-benzimidazole);bis(2H-benzimidazole);tris(1-benzofuran);1,3-benzothiazole;1-benzothiophene;bis(1,3-benzoxazole);2-(1,1-difluoroethyl)pyridine;3-(1,1-difluoroethyl)pyridine;N,N-dimethylpyrimidin-2-amine;2-ethyl-6-methoxypyridine;N-ethynyl-2-pyridin-4-ylethanamine;bis(furo[2,3-b]pyridine);imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;2H-indene;bis(1H-indole);2-methylideneindole;2-methyl-1,5-naphthyridine;1,5-naphthyridine;2-piperidin-1-ylpyridine;3-piperidin-1-ylpyridine;pyrazine;bis(pyridine);pyrimidine;2-pyrrolidin-1-yl-1,3-thiazole;1H-pyrrolo[3,2-b]pyridine;quinoline;[1,2,4]triazolo[1,5-a]pyridine
CID 162093117
4-[8-amino-1-(4-methyl-1-benzofuran-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(7-methyl-1-benzothiophen-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;[4-[8-amino-1-[7-(1,3-thiazol-2-yl)-1H-indol-2-yl]imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methanol
CID 91153354
4-[8-amino-1-(4-methyl-1-benzofuran-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(7-methyl-1-benzothiophen-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;4-[8-amino-1-[7-(1,3-thiazol-2-yl)-1H-indol-2-yl]imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;[4-[8-amino-1-[7-(1,3-thiazol-2-yl)-1H-indol-2-yl]imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methanol
CID 91229474

Frequently Asked Questions

What is the IUPAC name of 1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one?
The IUPAC name of 1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one (CID 158459312) is 1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one.
What is the SMILES notation for 1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one?
The canonical SMILES for 1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one is O=C1CNc2ccccc21.O=C1CNc2cccnc21.O=C1CNc2ccncc21.O=C1CNc2cnccc21.O=C1CNc2cnccc21.O=C1CNc2ncccc21.O=C1COc2ccccc21.O=C1COc2cccnc21.O=C1COc2ccncc21.O=C1COc2cnccc21.O=C1COc2ncccc21.O=C1CSc2ccccc21.O=C1CSc2cccnc21.O=C1CSc2ccncc21.O=C1CSc2cnccc21.O=C1CSc2ncccc21.c1cc2[nH]ccc2cn1.c1cc2cc[nH]c2cn1.c1cc2ccoc2cn1.c1cc2ccsc2cn1.c1cc2occc2cn1.c1cc2sccc2cn1.c1ccc2[nH]ccc2c1.c1ccc2occc2c1.c1ccc2sccc2c1.c1cnc2[nH]ccc2c1.c1cnc2cc[nH]c2c1.c1cnc2ccoc2c1.c1cnc2ccsc2c1.c1cnc2occc2c1.c1cnc2sccc2c1.
What is the InChIKey of 1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one?
The InChIKey is HEYWWTMGNODVFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NO.C8H7N.C8H6O2.C8H6OS.C8H6O.C8H6S.5C7H6N2O.4C7H6N2.4C7H5NO2.4C7H5NOS.4C7H5NO.4C7H5NS/c10-8-5-9-7-4-2-1-3-6(7)8;1-2-4-8-7(3-1)5-6-9-8;2*9-7-5-10-8-4-2-1-3-6(7)8;2*1-2-4-8-7(3-1)5-6-9-8;10-7-4-9-6-1-2-8-3-5(6)7;2*10-7-4-9-6-3-8-2-1-5(6)7;10-6-4-9-5-2-1-3-8-7(5)6;10-6-4-9-7-5(6)2-1-3-8-7;1-4-9-7-2-3-8-5-6(1)7;1-3-8-5-7-6(1)2-4-9-7;1-2-6-7(8-4-1)3-5-9-6;1-2-6-3-5-9-7(6)8-4-1;9-6-4-10-7-1-2-8-3-5(6)7;9-6-4-10-7-3-8-2-1-5(6)7;9-5-4-10-6-2-1-3-8-7(5)6;9-6-4-10-7-5(6)2-1-3-8-7;9-6-4-10-7-1-2-8-3-5(6)7;9-6-4-10-7-3-8-2-1-5(6)7;9-5-4-10-6-2-1-3-8-7(5)6;9-6-4-10-7-5(6)2-1-3-8-7;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-2-7-6(8-4-1)3-5-9-7;1-2-6-3-5-9-7(6)8-4-1;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-2-7-6(8-4-1)3-5-9-7;1-2-6-3-5-9-7(6)8-4-1/h1-4,9H,5H2;1-6,9H;2*1-4H,5H2;2*1-6H;4*1-3,9H,4H2;1-3H,4H2,(H,8,9);3*1-5,9H;1-5H,(H,8,9);8*1-3H,4H2;8*1-5H.
What are the key properties of 1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one?
1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one has a molecular weight of 4092.72 g/mol, XLogP of 46.34, 0 rotatable bonds, 11 hydrogen bond donors, and 67 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran;1-benzofuran-3-one;1-benzothiophene;1-benzothiophen-3-one;1,2-dihydroindol-3-one;1,2-dihydropyrrolo[2,3-b]pyridin-3-one;1,2-dihydropyrrolo[3,2-b]pyridin-3-one;bis(1,2-dihydropyrrolo[2,3-c]pyridin-3-one);1,2-dihydropyrrolo[3,2-c]pyridin-3-one;furo[2,3-b]pyridine;furo[3,2-b]pyridine;furo[2,3-b]pyridin-3-one;furo[3,2-b]pyridin-3-one;furo[2,3-c]pyridine;furo[3,2-c]pyridine;furo[2,3-c]pyridin-3-one;furo[3,2-c]pyridin-3-one;1H-indole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[2,3-b]pyridin-3-one;thieno[3,2-b]pyridin-3-one;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thieno[2,3-c]pyridin-3-one;thieno[3,2-c]pyridin-3-one is sourced from PubChem (CID 158459312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).