4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline

C101H94N16O10S5Si — CID 158132795

IUPAC4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline
SMILESCN(C)c1ccc(-c2cnc3c(c2)c(-c2cnn(S(=O)(=O)c4ccccc4)c2)cn3[Si](C)(C)C(C)(C)C)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(-c2ncc[nH]2)cn3S(=O)(=O)c2ccccc2)cc1.Cc1noc(C)c1-c1cn(S(=O)(=O)c2ccccc2)c2ncc(-c3ccc(N(C)C)cc3)cc12.O=S(=O)(c1ccccc1)n1cc(-c2ccoc2)c2cc(-c3cccs3)cnc21
InChIInChI=1S/C30H35N5O2SSi.C26H24N4O3S.C24H21N5O2S.C21H14N2O3S2/c1-30(2,3)39(6,7)34-21-28(24-19-32-35(20-24)38(36,37)26-11-9-8-10-12-26)27-17-23(18-31-29(27)34)22-13-15-25(16-14-22)33(4)5;1-17-25(18(2)33-28-17)24-16-30(34(31,32)22-8-6-5-7-9-22)26-23(24)14-20(15-27-26)19-10-12-21(13-11-19)29(3)4;1-28(2)19-10-8-17(9-11-19)18-14-21-22(23-25-12-13-26-23)16-29(24(21)27-15-18)32(30,31)20-6-4-3-5-7-20;24-28(25,17-5-2-1-3-6-17)23-13-19(15-8-9-26-14-15)18-11-16(12-22-21(18)23)20-7-4-10-27-20/h8-21H,1-7H3;5-16H,1-4H3;3-16H,1-2H3,(H,25,26);1-14H
InChIKeyFSZGHYJHJLYBPU-UHFFFAOYSA-N
MW1880.39 g/mol
LogP21.66
Rot. Bonds20

About 4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline

4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline (PubChem CID 158132795) has the molecular formula C101H94N16O10S5Si and a molecular weight of 1880.39 g/mol. Its IUPAC name is 4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline
PubChem CID158132795
Molecular FormulaC101H94N16O10S5Si
Molecular Weight1880.39 g/mol
Exact Mass1878.57
IUPAC Name4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline
SMILESCN(C)c1ccc(-c2cnc3c(c2)c(-c2cnn(S(=O)(=O)c4ccccc4)c2)cn3[Si](C)(C)C(C)(C)C)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(-c2ncc[nH]2)cn3S(=O)(=O)c2ccccc2)cc1.Cc1noc(C)c1-c1cn(S(=O)(=O)c2ccccc2)c2ncc(-c3ccc(N(C)C)cc3)cc12.O=S(=O)(c1ccccc1)n1cc(-c2ccoc2)c2cc(-c3cccs3)cnc21
InChIInChI=1S/C30H35N5O2SSi.C26H24N4O3S.C24H21N5O2S.C21H14N2O3S2/c1-30(2,3)39(6,7)34-21-28(24-19-32-35(20-24)38(36,37)26-11-9-8-10-12-26)27-17-23(18-31-29(27)34)22-13-15-25(16-14-22)33(4)5;1-17-25(18(2)33-28-17)24-16-30(34(31,32)22-8-6-5-7-9-22)26-23(24)14-20(15-27-26)19-10-12-21(13-11-19)29(3)4;1-28(2)19-10-8-17(9-11-19)18-14-21-22(23-25-12-13-26-23)16-29(24(21)27-15-18)32(30,31)20-6-4-3-5-7-20;24-28(25,17-5-2-1-3-6-17)23-13-19(15-8-9-26-14-15)18-11-16(12-22-21(18)23)20-7-4-10-27-20/h8-21H,1-7H3;5-16H,1-4H3;3-16H,1-2H3,(H,25,26);1-14H
InChIKeyFSZGHYJHJLYBPU-UHFFFAOYSA-N
XLogP21.66
TPSA303.23 Ų
H-Bond Donors1
H-Bond Acceptors26
Rotatable Bonds20
Heavy Atoms133
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001880.39
LogP ≤ 521.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

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

Analyze 4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline with MolForge

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Related Compounds

N,N-diethyl-4-propylaniline;N,N-dimethyl-4-propylaniline;3,5-dimethyl-4-propyl-1,2-oxazole;3,5-dimethyl-4-propyl-1H-pyrazole;4-ethyl-N,N-dimethylaniline;4-ethyl-1-oxidopyridin-1-ium;1-ethyl-4-propan-2-ylbenzene;1-ethyl-3-propan-2-ylpyrazole;2-ethyl-1,3-thiazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propylimidazole;1-methylsulfonyl-4-propan-2-ylbenzene;1-nitro-4-propylbenzene;4-propan-2-yl-1-propylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;3-propan-2-ylthiophene;4-propylbenzenesulfonamide;2-propylfuran;5-propyl-1H-imidazole;2-propylpyrazine;2-propylpyridine;3-propylpyridine;4-propylpyridine;2-propylthiophene;2-(1,1,1-trifluoropropan-2-yl)furan;2-(1,1,1-trifluoropropan-2-yl)pyridine
CID 158380816
2-benzofuran;2H-chromene;cinnoline;furan;1H-imidazole;1H-indazole;1H-indole;3H-indole;indolizine;2H-isoindole;isoquinoline;1,8-naphthyridine;1,2-oxazole;phenoxathiine;phthalazine;7H-purine;2H-pyran;pyrazine;pyrazino[2,3-b]pyrazine;1H-pyrazole;pyridazine;pyridine;pyrimidine;1H-pyrrole;2H-pyrrole;quinazoline;quinoline;4H-quinolizine;quinoxaline;thianthrene;1,2-thiazole;thiophene;9H-xanthene
CID 157304081
3-methyl-5H-cyclopenta[b]pyridine;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[3,2-c]pyridin-4-amine;3-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;3-methylimidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;5-methyl-3H-indazole;6-methyl-1H-indole;6-methyl-1H-isoindole;5-methyl-1H-pyrazolo[4,5-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-c]pyridine;3-methyl-5H-pyrrolo[3,4-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;3-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-3H-pyrrolo[2,3-c]pyridine;bis(6-methyl-1H-pyrrolo[3,4-c]pyridine);2-methylthieno[3,2-c]pyridin-4-amine;3-methylthieno[3,2-c]pyridin-4-amine
CID 157361556
3-tert-butyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(2-cyclopentylethyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-pentan-2-yl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;N-(3-thiophen-3-yl-1-benzofuran-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(3-thiophen-3-yl-1-benzofuran-6-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 157503700
1-benzofuran;1-benzothiophene;1H-indole;isoquinoline;1,2-oxazole;pyrazine;pyridazine;pyrimidine;quinoline;1,2-thiazole
CID 157702801
6-methylcinnoline;3-methyl-2-(5-methylthiophen-2-yl)-1H-imidazol-3-ium;3-methyl-1,5-naphthyridine;3-methyl-1,6-naphthyridine;3-methyl-1,8-naphthyridine;bis(5-methyl-3-pyridin-2-yl-1,2-oxazole);3-methylquinoline;6-methylquinoline;7-methylquinoline;bis(5-methyl-3-quinolin-3-yl-1,2-oxazole);5-methylthieno[2,3-b]pyridine;2-(5-methylthiophen-2-yl)furan;2-(5-methylthiophen-2-yl)pyrazine;2-(5-methylthiophen-2-yl)pyridine;3-(5-methylthiophen-2-yl)pyridine;4-(5-methylthiophen-2-yl)pyridine;5-(5-methylthiophen-2-yl)pyridine-3-carbonitrile;2-(5-methylthiophen-2-yl)pyrimidine;5-(5-methylthiophen-2-yl)pyrimidine;2-(5-methylthiophen-2-yl)-1,3-thiazole;4-(5-methylthiophen-2-yl)-1,3-thiazole;5-(5-methylthiophen-2-yl)-1,3-thiazole
CID 157712501
5-methyl-2H-benzotriazole;2-methylfuro[3,2-c]pyridin-4-amine;3-methylfuro[3,2-c]pyridin-4-amine;3-methylimidazo[4,5-c]pyridin-4-amine;6-methyl-3H-imidazo[4,5-c]pyridine;5-methyl-1H-pyrazolo[4,5-b]pyridine;6-methyl-1H-pyrazolo[4,5-c]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;3-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[3,2-c]pyridin-4-amine;3-methylthieno[3,2-c]pyridin-4-amine
CID 157807543
N-(3-tert-butyl-1-benzofuran-6-yl)-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-(3-tert-butyl-1-benzofuran-6-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine;3-(2-cyclopentylethyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;N-(3-thiophen-3-yl-1-benzofuran-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(3-thiophen-3-yl-1-benzofuran-6-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 157925288
3-tert-butyl-1-benzofuran;3-tert-butyl-1-benzothiophene;3-tert-butyl-1,2-benzoxazole;3-tert-butyl-2H-indazole;2-tert-butyl-1H-indole;3-tert-butyl-1H-indole;4-tert-butyl-1H-indole;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;7-tert-butyl-1H-indole;3-tert-butyl-1H-pyrrolo[2,3-b]pyridine;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;3-tert-butyl-1H-pyrrolo[2,3-c]pyridine
CID 157977932
1-propan-2-ylbenzimidazole;3-propan-2-yl-1H-benzimidazol-2-one;3-propan-2-yl-1-benzofuran;3-propan-2-yl-1,2-benzothiazole;3-propan-2-yl-1-benzothiophene;1-propan-2-ylbenzotriazole;3-propan-2-yl-1,2-benzoxazole;3-propan-2-ylimidazo[1,2-a]pyrazine;3-propan-2-ylimidazo[1,2-a]pyridine;1-propan-2-ylindazole;3-propan-2-yl-2H-indazole;1-propan-2-yl-2H-indazol-3-one;1-propan-2-yl-3H-indol-2-one;3-propan-2-ylpyrazolo[1,5-a]pyrimidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;1-propan-2-ylpyrrolo[3,2-b]pyridine;1-propan-2-ylpyrrolo[2,3-c]pyridine;1-propan-2-ylpyrrolo[3,2-c]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;3-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[3,2-c]pyridine
CID 158060995
4aH-carbazole;acridine;2-benzofuran;9H-carbazole;2H-chromene;cinnoline;furan;1H-imidazole;1H-indazole;1H-indole;3H-indole;indolizine;2H-isoindole;isoquinoline;1,8-naphthyridine;1,2-oxazole;phenanthridine;phenoxathiine;phthalazine;7H-purine;2H-pyran;pyrazine;pyrazino[2,3-b]pyrazine;1H-pyrazole;pyridazine;pyridine;9H-pyrido[3,4-b]indole;pyrimidine;1H-pyrrole;2H-pyrrole;quinazoline;quinoline;4H-quinolizine;quinoxaline;thianthrene;1,2-thiazole;thiophene;9H-xanthene
CID 158505940
1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;N,N-dimethylpyrazin-2-amine;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-fluoropyridine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;2-(2-methoxyethoxy)pyridine;2-methoxypyridine;3-methoxypyridine;4-methoxypyridine;2-methylpyrazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine
CID 158595599

Frequently Asked Questions

What is the IUPAC name of 4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline?
The IUPAC name of 4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline (CID 158132795) is 4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline?
The canonical SMILES for 4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline is CN(C)c1ccc(-c2cnc3c(c2)c(-c2cnn(S(=O)(=O)c4ccccc4)c2)cn3[Si](C)(C)C(C)(C)C)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(-c2ncc[nH]2)cn3S(=O)(=O)c2ccccc2)cc1.Cc1noc(C)c1-c1cn(S(=O)(=O)c2ccccc2)c2ncc(-c3ccc(N(C)C)cc3)cc12.O=S(=O)(c1ccccc1)n1cc(-c2ccoc2)c2cc(-c3cccs3)cnc21.
What is the InChIKey of 4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline?
The InChIKey is FSZGHYJHJLYBPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H35N5O2SSi.C26H24N4O3S.C24H21N5O2S.C21H14N2O3S2/c1-30(2,3)39(6,7)34-21-28(24-19-32-35(20-24)38(36,37)26-11-9-8-10-12-26)27-17-23(18-31-29(27)34)22-13-15-25(16-14-22)33(4)5;1-17-25(18(2)33-28-17)24-16-30(34(31,32)22-8-6-5-7-9-22)26-23(24)14-20(15-27-26)19-10-12-21(13-11-19)29(3)4;1-28(2)19-10-8-17(9-11-19)18-14-21-22(23-25-12-13-26-23)16-29(24(21)27-15-18)32(30,31)20-6-4-3-5-7-20;24-28(25,17-5-2-1-3-6-17)23-13-19(15-8-9-26-14-15)18-11-16(12-22-21(18)23)20-7-4-10-27-20/h8-21H,1-7H3;5-16H,1-4H3;3-16H,1-2H3,(H,25,26);1-14H.
What are the key properties of 4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline?
4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline has a molecular weight of 1880.39 g/mol, XLogP of 21.66, 20 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(benzenesulfonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-(benzenesulfonyl)-3-(furan-3-yl)-5-thiophen-2-ylpyrrolo[2,3-b]pyridine;4-[1-(benzenesulfonyl)-3-(1H-imidazol-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1-[tert-butyl(dimethyl)silyl]pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline is sourced from PubChem (CID 158132795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).