1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate

C143H124N14O15S5Si — CID 161465501

IUPAC1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate
SMILESCN(C)c1ccc(-c2cnc3c(c2)c(C#CC(O)C2CCCC2)cn3OOSc2ccccc2)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(C#CCOc2ccccc2)cn3OOSc2ccccc2)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(C#C[Si](C)(C)C)cn3OOSc2ccccc2)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(C#Cc2ccccc2)cn3OOSc2ccccc2)cc1.COC(=O)C#Cc1cn(OOSc2ccccc2)c2ncc(-c3ccccc3Oc3ccccc3)cc12
InChIInChI=1S/C30H25N3O3S.C29H29N3O3S.C29H23N3O2S.C29H20N2O5S.C26H27N3O2SSi/c1-32(2)26-17-15-23(16-18-26)25-20-29-24(10-9-19-34-27-11-5-3-6-12-27)22-33(30(29)31-21-25)35-36-37-28-13-7-4-8-14-28;1-31(2)25-15-12-21(13-16-25)24-18-27-23(14-17-28(33)22-8-6-7-9-22)20-32(29(27)30-19-24)34-35-36-26-10-4-3-5-11-26;1-31(2)26-17-15-23(16-18-26)25-19-28-24(14-13-22-9-5-3-6-10-22)21-32(29(28)30-20-25)33-34-35-27-11-7-4-8-12-27;1-33-28(32)17-16-21-20-31(35-36-37-24-12-6-3-7-13-24)29-26(21)18-22(19-30-29)25-14-8-9-15-27(25)34-23-10-4-2-5-11-23;1-28(2)23-13-11-20(12-14-23)22-17-25-21(15-16-33(3,4)5)19-29(26(25)27-18-22)30-31-32-24-9-7-6-8-10-24/h3-8,11-18,20-22H,19H2,1-2H3;3-5,10-13,15-16,18-20,22,28,33H,6-9H2,1-2H3;3-12,15-21H,1-2H3;2-15,18-20H,1H3;6-14,17-19H,1-5H3
InChIKeyWCJIHMHNDNMYAQ-UHFFFAOYSA-N
MW2467.07 g/mol
LogP30.40
Rot. Bonds34

About 1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate

1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate (PubChem CID 161465501) has the molecular formula C143H124N14O15S5Si and a molecular weight of 2467.07 g/mol. Its IUPAC name is 1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate.

Molecular Properties

Compound Name1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate
PubChem CID161465501
Molecular FormulaC143H124N14O15S5Si
Molecular Weight2467.07 g/mol
Exact Mass2464.77
IUPAC Name1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate
SMILESCN(C)c1ccc(-c2cnc3c(c2)c(C#CC(O)C2CCCC2)cn3OOSc2ccccc2)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(C#CCOc2ccccc2)cn3OOSc2ccccc2)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(C#C[Si](C)(C)C)cn3OOSc2ccccc2)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(C#Cc2ccccc2)cn3OOSc2ccccc2)cc1.COC(=O)C#Cc1cn(OOSc2ccccc2)c2ncc(-c3ccccc3Oc3ccccc3)cc12
InChIInChI=1S/C30H25N3O3S.C29H29N3O3S.C29H23N3O2S.C29H20N2O5S.C26H27N3O2SSi/c1-32(2)26-17-15-23(16-18-26)25-20-29-24(10-9-19-34-27-11-5-3-6-12-27)22-33(30(29)31-21-25)35-36-37-28-13-7-4-8-14-28;1-31(2)25-15-12-21(13-16-25)24-18-27-23(14-17-28(33)22-8-6-7-9-22)20-32(29(27)30-19-24)34-35-36-26-10-4-3-5-11-26;1-31(2)26-17-15-23(16-18-26)25-19-28-24(14-13-22-9-5-3-6-10-22)21-32(29(28)30-20-25)33-34-35-27-11-7-4-8-12-27;1-33-28(32)17-16-21-20-31(35-36-37-24-12-6-3-7-13-24)29-26(21)18-22(19-30-29)25-14-8-9-15-27(25)34-23-10-4-2-5-11-23;1-28(2)23-13-11-20(12-14-23)22-17-25-21(15-16-33(3,4)5)19-29(26(25)27-18-22)30-31-32-24-9-7-6-8-10-24/h3-8,11-18,20-22H,19H2,1-2H3;3-5,10-13,15-16,18-20,22,28,33H,6-9H2,1-2H3;3-12,15-21H,1-2H3;2-15,18-20H,1H3;6-14,17-19H,1-5H3
InChIKeyWCJIHMHNDNMYAQ-UHFFFAOYSA-N
XLogP30.40
TPSA259.35 Ų
H-Bond Donors1
H-Bond Acceptors34
Rotatable Bonds34
Heavy Atoms178
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002467.07
LogP ≤ 530.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1034

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'sulfur_oxygen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate with MolForge

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Related Compounds

4-[1-[tert-butyl(dimethyl)silyl]-3-(3-fluorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;3-(2-chloro-4-pyridinyl)-5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridine;1-methyl-5-(2-phenoxyphenyl)-3-pyridin-4-ylpyrrolo[2,3-b]pyridine;5-(2-phenoxyphenyl)-1-phenylsulfanylperoxy-3-pyridin-2-ylpyrrolo[2,3-b]pyridine;5-(2-phenoxyphenyl)-1-phenylsulfanylperoxy-3-pyrimidin-5-ylpyrrolo[2,3-b]pyridine
CID 158332952
5-bromo-3-(2-phenylethynyl)-1-phenylperoxysulfanylpyrrolo[2,3-b]pyridine;4-[1-[tert-butyl(dimethyl)silyl]-3-ethynylpyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;4-[2-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]ethynyl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-pyridin-2-ylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline
CID 159098379
3-(4-Fluorophenyl)-1-methyl-5-(2-phenoxyphenyl)pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-1-methyl-5-(2-phenoxyphenyl)pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridine;3-methyl-5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridine;3-(2-methylphenyl)-5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridine
CID 159161171
4-[1-[tert-butyl(dimethyl)silyl]-3-(3-fluorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;3-(2-chloro-4-pyridinyl)-5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridine;3-(6-chloro-3-pyridinyl)-5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridine;5-(2-phenoxyphenyl)-1-phenylsulfanylperoxy-3-pyridin-2-ylpyrrolo[2,3-b]pyridine
CID 159820755
3-(3-Fluorophenyl)-5-phenyl-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-5-phenyl-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridine
CID 160399098
N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;3-[3-[(4-methoxyphenyl)methoxy]prop-1-ynyl]-5-phenyl-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridine;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate
CID 162252440

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate?
The IUPAC name of 1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate (CID 161465501) is 1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate.
What is the SMILES notation for 1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate?
The canonical SMILES for 1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate is CN(C)c1ccc(-c2cnc3c(c2)c(C#CC(O)C2CCCC2)cn3OOSc2ccccc2)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(C#CCOc2ccccc2)cn3OOSc2ccccc2)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(C#C[Si](C)(C)C)cn3OOSc2ccccc2)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(C#Cc2ccccc2)cn3OOSc2ccccc2)cc1.COC(=O)C#Cc1cn(OOSc2ccccc2)c2ncc(-c3ccccc3Oc3ccccc3)cc12.
What is the InChIKey of 1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate?
The InChIKey is WCJIHMHNDNMYAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25N3O3S.C29H29N3O3S.C29H23N3O2S.C29H20N2O5S.C26H27N3O2SSi/c1-32(2)26-17-15-23(16-18-26)25-20-29-24(10-9-19-34-27-11-5-3-6-12-27)22-33(30(29)31-21-25)35-36-37-28-13-7-4-8-14-28;1-31(2)25-15-12-21(13-16-25)24-18-27-23(14-17-28(33)22-8-6-7-9-22)20-32(29(27)30-19-24)34-35-36-26-10-4-3-5-11-26;1-31(2)26-17-15-23(16-18-26)25-19-28-24(14-13-22-9-5-3-6-10-22)21-32(29(28)30-20-25)33-34-35-27-11-7-4-8-12-27;1-33-28(32)17-16-21-20-31(35-36-37-24-12-6-3-7-13-24)29-26(21)18-22(19-30-29)25-14-8-9-15-27(25)34-23-10-4-2-5-11-23;1-28(2)23-13-11-20(12-14-23)22-17-25-21(15-16-33(3,4)5)19-29(26(25)27-18-22)30-31-32-24-9-7-6-8-10-24/h3-8,11-18,20-22H,19H2,1-2H3;3-5,10-13,15-16,18-20,22,28,33H,6-9H2,1-2H3;3-12,15-21H,1-2H3;2-15,18-20H,1H3;6-14,17-19H,1-5H3.
What are the key properties of 1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate?
1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate has a molecular weight of 2467.07 g/mol, XLogP of 30.40, 34 rotatable bonds, 1 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[5-[4-(dimethylamino)phenyl]-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-yn-1-ol;N,N-dimethyl-4-[3-(3-phenoxyprop-1-ynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(2-phenylethynyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[1-phenylsulfanylperoxy-3-(2-trimethylsilylethynyl)pyrrolo[2,3-b]pyridin-5-yl]aniline;methyl 3-[5-(2-phenoxyphenyl)-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-3-yl]prop-2-ynoate is sourced from PubChem (CID 161465501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).