benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride

C206H197ClFIN11O12P4PdSn- — CID 159960703

IUPACbenzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride
SMILESC.C=Cc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1.CCCC[Sn](CCCC)(CCCC)c1ccc(C2OCCO2)o1.CN=O.Cl.Ic1nn(Cc2ccccc2)c2ccccc12.O=Cc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1.O=Cc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1.[2H]CF.[CH3-].[Pd].c1ccc(-c2ccccc2)cc1.c1ccc(Cn2nc(-c3ccc(C4OCCO4)o3)c3ccccc32)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccccc1
InChIInChI=1S/C21H18N2O3.C20H16N2O.2C19H14N2O2.4C18H15P.C14H11IN2.C12H10.C7H7O3.C6H6.3C4H9.CH3F.CH3NO.CH4.CH3.ClH.Pd.Sn/c1-2-6-15(7-3-1)14-23-17-9-5-4-8-16(17)20(22-23)18-10-11-19(26-18)21-24-12-13-25-21;1-2-16-12-13-19(23-16)20-17-10-6-7-11-18(17)22(21-20)14-15-8-4-3-5-9-15;2*22-13-15-10-11-18(23-15)19-16-8-4-5-9-17(16)21(20-19)12-14-6-2-1-3-7-14;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;15-14-12-8-4-5-9-13(12)17(16-14)10-11-6-2-1-3-7-11;1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-6(8-3-1)7-9-4-5-10-7;1-2-4-6-5-3-1;3*1-3-4-2;1-2;1-2-3;;;;;/h1-11,21H,12-14H2;2-13H,1,14H2;2*1-11,13H,12H2;4*1-15H;1-9H,10H2;1-10H;1-2,7H,4-5H2;1-6H;3*1,3-4H2,2H3;1H3;1H3;1H4;1H3;1H;;/q;;;;;;;;;;;;;;;;;;-1;;;/i;;;;;;;;;;;;;;;1D;;;;;;
InChIKeyFXSVFIXRDUIGHA-IGUNXVIESA-N
MW3550.30 g/mol
LogP48.06
Rot. Bonds42

About benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride

benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride (PubChem CID 159960703) has the molecular formula C206H197ClFIN11O12P4PdSn- and a molecular weight of 3550.30 g/mol. Its IUPAC name is benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride.

Molecular Properties

Compound Namebenzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride
PubChem CID159960703
Molecular FormulaC206H197ClFIN11O12P4PdSn-
Molecular Weight3550.30 g/mol
Exact Mass3548.09
IUPAC Namebenzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride
SMILESC.C=Cc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1.CCCC[Sn](CCCC)(CCCC)c1ccc(C2OCCO2)o1.CN=O.Cl.Ic1nn(Cc2ccccc2)c2ccccc12.O=Cc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1.O=Cc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1.[2H]CF.[CH3-].[Pd].c1ccc(-c2ccccc2)cc1.c1ccc(Cn2nc(-c3ccc(C4OCCO4)o3)c3ccccc32)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccccc1
InChIInChI=1S/C21H18N2O3.C20H16N2O.2C19H14N2O2.4C18H15P.C14H11IN2.C12H10.C7H7O3.C6H6.3C4H9.CH3F.CH3NO.CH4.CH3.ClH.Pd.Sn/c1-2-6-15(7-3-1)14-23-17-9-5-4-8-16(17)20(22-23)18-10-11-19(26-18)21-24-12-13-25-21;1-2-16-12-13-19(23-16)20-17-10-6-7-11-18(17)22(21-20)14-15-8-4-3-5-9-15;2*22-13-15-10-11-18(23-15)19-16-8-4-5-9-17(16)21(20-19)12-14-6-2-1-3-7-14;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;15-14-12-8-4-5-9-13(12)17(16-14)10-11-6-2-1-3-7-11;1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-6(8-3-1)7-9-4-5-10-7;1-2-4-6-5-3-1;3*1-3-4-2;1-2;1-2-3;;;;;/h1-11,21H,12-14H2;2-13H,1,14H2;2*1-11,13H,12H2;4*1-15H;1-9H,10H2;1-10H;1-2,7H,4-5H2;1-6H;3*1,3-4H2,2H3;1H3;1H3;1H4;1H3;1H;;/q;;;;;;;;;;;;;;;;;;-1;;;/i;;;;;;;;;;;;;;;1D;;;;;;
InChIKeyFXSVFIXRDUIGHA-IGUNXVIESA-N
XLogP48.06
TPSA255.29 Ų
H-Bond Donors
H-Bond Acceptors23
Rotatable Bonds42
Heavy Atoms238
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003550.30
LogP ≤ 548.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride with MolForge

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Related Compounds

(NE)-N-[[5-(1-benzylindazol-3-yl)furan-2-yl]methylidene]hydroxylamine;5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-carbaldehyde;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methyl acetate
CID 136470293
1-Benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-[5-(1-benzylindazol-3-yl)furan-2-yl]ethane-1,2-diol;carbanide;deuterio(fluoro)methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);triphenylphosphanium;hydrochloride
CID 157092758
N-[[5-(1-benzylindazol-3-yl)furan-2-yl]methyl]-N-ethylethanamine;1-benzyl-3-(5-methylfuran-2-yl)indazole;methyl 5-(1-benzylindazol-3-yl)furan-2-carboxylate;5-(1-phenylindazol-3-yl)furan-2-carboxylic acid;[5-(1-phenylindazol-3-yl)furan-2-yl]methanol
CID 158269961
N-[[5-(1-benzylindazol-3-yl)furan-2-yl]methylidene]hydroxylamine;5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-carbaldehyde;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methyl acetate
CID 173273437
1-Benzyl-3-[5-(methoxymethoxymethyl)furan-2-yl]indazole;1-benzyl-3-[5-(oxiran-2-ylmethoxymethyl)furan-2-yl]indazole;5-[1-[(2-fluorophenyl)methyl]indazol-3-yl]furan-2-carbaldehyde;4-[[3-(5-formylfuran-2-yl)indazol-1-yl]methyl]benzonitrile;5-[1-[(3-methoxyphenyl)methyl]indazol-3-yl]furan-2-carbaldehyde
CID 173273438
1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;5-(1-benzylindazol-3-yl)furan-2-carbaldehyde;1-[5-(1-benzylindazol-3-yl)furan-2-yl]ethanol;3-[5-(1,3-dioxolan-2-yl)furan-2-yl]-1H-indazole;2-[[3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazol-1-yl]methyl]benzonitrile;2-[[3-(5-formylfuran-2-yl)indazol-1-yl]methyl]benzonitrile;2-[[3-[5-(hydroxymethyl)furan-2-yl]indazol-1-yl]methyl]benzonitrile
CID 173273500

Frequently Asked Questions

What is the IUPAC name of benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride?
The IUPAC name of benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride (CID 159960703) is benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride.
What is the SMILES notation for benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride?
The canonical SMILES for benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride is C.C=Cc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1.CCCC[Sn](CCCC)(CCCC)c1ccc(C2OCCO2)o1.CN=O.Cl.Ic1nn(Cc2ccccc2)c2ccccc12.O=Cc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1.O=Cc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1.[2H]CF.[CH3-].[Pd].c1ccc(-c2ccccc2)cc1.c1ccc(Cn2nc(-c3ccc(C4OCCO4)o3)c3ccccc32)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccccc1.
What is the InChIKey of benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride?
The InChIKey is FXSVFIXRDUIGHA-IGUNXVIESA-N. The full InChI is InChI=1S/C21H18N2O3.C20H16N2O.2C19H14N2O2.4C18H15P.C14H11IN2.C12H10.C7H7O3.C6H6.3C4H9.CH3F.CH3NO.CH4.CH3.ClH.Pd.Sn/c1-2-6-15(7-3-1)14-23-17-9-5-4-8-16(17)20(22-23)18-10-11-19(26-18)21-24-12-13-25-21;1-2-16-12-13-19(23-16)20-17-10-6-7-11-18(17)22(21-20)14-15-8-4-3-5-9-15;2*22-13-15-10-11-18(23-15)19-16-8-4-5-9-17(16)21(20-19)12-14-6-2-1-3-7-14;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;15-14-12-8-4-5-9-13(12)17(16-14)10-11-6-2-1-3-7-11;1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-6(8-3-1)7-9-4-5-10-7;1-2-4-6-5-3-1;3*1-3-4-2;1-2;1-2-3;;;;;/h1-11,21H,12-14H2;2-13H,1,14H2;2*1-11,13H,12H2;4*1-15H;1-9H,10H2;1-10H;1-2,7H,4-5H2;1-6H;3*1,3-4H2,2H3;1H3;1H3;1H4;1H3;1H;;/q;;;;;;;;;;;;;;;;;;-1;;;/i;;;;;;;;;;;;;;;1D;;;;;;.
What are the key properties of benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride?
benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride has a molecular weight of 3550.30 g/mol, XLogP of 48.06, 42 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;1-benzyl-3-[5-(1,3-dioxolan-2-yl)furan-2-yl]indazole;1-benzyl-3-(5-ethenylfuran-2-yl)indazole;bis(5-(1-benzylindazol-3-yl)furan-2-carbaldehyde);1-benzyl-3-iodoindazole;1,1'-biphenyl;carbanide;deuterio(fluoro)methane;methane;nitrosomethane;palladium;tributyl-[5-(1,3-dioxolan-2-yl)furan-2-yl]stannane;tetrakis(triphenylphosphane);hydrochloride is sourced from PubChem (CID 159960703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).