methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten

C142H175BN9O5P4PdSi5W- — CID 158298192

IUPACmethane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten
SMILESC.CC(C)[Si](C(C)C)(C(C)C)n1ccc(-c2ccnc3c2ccn3COCC[Si](C)(C)C)c1.CC(C)[Si](C(C)C)(C(C)C)n1ccc(B(O)O)c1.C[Si](C)(C)CCOCn1ccc2[c-]ccnc21.C[Si](C)(C)CCOCn1ccc2c(-c3cc[nH]c3)ccnc21.[Pd].[W].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H43N3OSi2.4C18H15P.C17H23N3OSi.C13H26BNO2Si.C13H19N2OSi.CH4.Pd.W/c1-20(2)32(21(3)4,22(5)6)29-15-11-23(18-29)24-10-13-27-26-25(24)12-14-28(26)19-30-16-17-31(7,8)9;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-22(2,3)11-10-21-13-20-9-6-16-15(5-8-19-17(16)20)14-4-7-18-12-14;1-10(2)18(11(3)4,12(5)6)15-8-7-13(9-15)14(16)17;1-17(2,3)10-9-16-11-15-8-6-12-5-4-7-14-13(12)15;;;/h10-15,18,20-22H,16-17,19H2,1-9H3;4*1-15H;4-9,12,18H,10-11,13H2,1-3H3;7-12,16-17H,1-6H3;4,6-8H,9-11H2,1-3H3;1H4;;/q;;;;;;;-1;;;
InChIKeyHNZDAIGOWKZBEP-UHFFFAOYSA-N
MW2653.42 g/mol
LogP31.93
Rot. Bonds38

About methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten

methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten (PubChem CID 158298192) has the molecular formula C142H175BN9O5P4PdSi5W- and a molecular weight of 2653.42 g/mol. Its IUPAC name is methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten.

Molecular Properties

Compound Namemethane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten
PubChem CID158298192
Molecular FormulaC142H175BN9O5P4PdSi5W-
Molecular Weight2653.42 g/mol
Exact Mass2651.02
IUPAC Namemethane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten
SMILESC.CC(C)[Si](C(C)C)(C(C)C)n1ccc(-c2ccnc3c2ccn3COCC[Si](C)(C)C)c1.CC(C)[Si](C(C)C)(C(C)C)n1ccc(B(O)O)c1.C[Si](C)(C)CCOCn1ccc2[c-]ccnc21.C[Si](C)(C)CCOCn1ccc2c(-c3cc[nH]c3)ccnc21.[Pd].[W].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H43N3OSi2.4C18H15P.C17H23N3OSi.C13H26BNO2Si.C13H19N2OSi.CH4.Pd.W/c1-20(2)32(21(3)4,22(5)6)29-15-11-23(18-29)24-10-13-27-26-25(24)12-14-28(26)19-30-16-17-31(7,8)9;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-22(2,3)11-10-21-13-20-9-6-16-15(5-8-19-17(16)20)14-4-7-18-12-14;1-10(2)18(11(3)4,12(5)6)15-8-7-13(9-15)14(16)17;1-17(2,3)10-9-16-11-15-8-6-12-5-4-7-14-13(12)15;;;/h10-15,18,20-22H,16-17,19H2,1-9H3;4*1-15H;4-9,12,18H,10-11,13H2,1-3H3;7-12,16-17H,1-6H3;4,6-8H,9-11H2,1-3H3;1H4;;/q;;;;;;;-1;;;
InChIKeyHNZDAIGOWKZBEP-UHFFFAOYSA-N
XLogP31.93
TPSA147.26 Ų
H-Bond Donors3
H-Bond Acceptors13
Rotatable Bonds38
Heavy Atoms168
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002653.42
LogP ≤ 531.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten with MolForge

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Related Compounds

2-[(4-chloropyrrolo[2,3-d]pyrimidin-7-yl)methoxy]ethyl-trimethylsilane;palladium;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-d]pyrimidin-7-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid
CID 157150014
3-[1-[3-[tert-butyl(diphenyl)silyl]oxypropyl]pyrrolo[2,3-b]pyridin-3-yl]-4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrole-2,5-dione;3-[1-(3-hydroxypropyl)pyrrolo[2,3-b]pyridin-3-yl]-4-(1H-pyrrol-3-yl)pyrrole-2,5-dione;oxolane;palladium;bis(tritert-butylphosphane)
CID 158651461
palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten
CID 159542648
1-(1-ethoxyethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole;2-[(5-fluoro-4-iodopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-[[5-fluoro-4-(1H-pyrazol-4-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;palladium;tetrakis(triphenylphosphane)
CID 159685487
2-[(4-chloropyrrolo[2,3-d]pyrimidin-7-yl)methoxy]ethyl-trimethylsilane;methane;palladium;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-d]pyrimidin-7-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid
CID 159931978

Frequently Asked Questions

What is the IUPAC name of methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten?
The IUPAC name of methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten (CID 158298192) is methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten.
What is the SMILES notation for methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten?
The canonical SMILES for methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten is C.CC(C)[Si](C(C)C)(C(C)C)n1ccc(-c2ccnc3c2ccn3COCC[Si](C)(C)C)c1.CC(C)[Si](C(C)C)(C(C)C)n1ccc(B(O)O)c1.C[Si](C)(C)CCOCn1ccc2[c-]ccnc21.C[Si](C)(C)CCOCn1ccc2c(-c3cc[nH]c3)ccnc21.[Pd].[W].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten?
The InChIKey is HNZDAIGOWKZBEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H43N3OSi2.4C18H15P.C17H23N3OSi.C13H26BNO2Si.C13H19N2OSi.CH4.Pd.W/c1-20(2)32(21(3)4,22(5)6)29-15-11-23(18-29)24-10-13-27-26-25(24)12-14-28(26)19-30-16-17-31(7,8)9;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-22(2,3)11-10-21-13-20-9-6-16-15(5-8-19-17(16)20)14-4-7-18-12-14;1-10(2)18(11(3)4,12(5)6)15-8-7-13(9-15)14(16)17;1-17(2,3)10-9-16-11-15-8-6-12-5-4-7-14-13(12)15;;;/h10-15,18,20-22H,16-17,19H2,1-9H3;4*1-15H;4-9,12,18H,10-11,13H2,1-3H3;7-12,16-17H,1-6H3;4,6-8H,9-11H2,1-3H3;1H4;;/q;;;;;;;-1;;;.
What are the key properties of methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten?
methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten has a molecular weight of 2653.42 g/mol, XLogP of 31.93, 38 rotatable bonds, 3 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for methane;palladium;trimethyl-[2-(4H-pyrrolo[2,3-b]pyridin-4-id-1-ylmethoxy)ethyl]silane;trimethyl-[2-[[4-(1H-pyrrol-3-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[4-[1-tri(propan-2-yl)silylpyrrol-3-yl]pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane;tetrakis(triphenylphosphane);[1-tri(propan-2-yl)silylpyrrol-3-yl]boronic acid;tungsten is sourced from PubChem (CID 158298192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).