7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine

C46H34N2O2Si — CID 140845196

IUPAC7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine
SMILESC[Si]1(C)c2ccc(N(c3ccccc3)c3ccccc3)cc2-c2oc3cc(N(c4ccccc4)c4cccc5c4oc4ccccc45)ccc3c21
InChIInChI=1S/C46H34N2O2Si/c1-51(2)43-28-26-34(47(31-15-6-3-7-16-31)32-17-8-4-9-18-32)29-39(43)45-46(51)38-27-25-35(30-42(38)50-45)48(33-19-10-5-11-20-33)40-23-14-22-37-36-21-12-13-24-41(36)49-44(37)40/h3-30H,1-2H3
InChIKeyLOTYGCWLRWKDDL-UHFFFAOYSA-N
MW674.88 g/mol
LogP12.07
Rot. Bonds6

About 7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine

7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine (PubChem CID 140845196) has the molecular formula C46H34N2O2Si and a molecular weight of 674.88 g/mol. Its IUPAC name is 7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine.

Molecular Properties

Compound Name7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine
PubChem CID140845196
Molecular FormulaC46H34N2O2Si
Molecular Weight674.88 g/mol
Exact Mass674.24
IUPAC Name7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine
SMILESC[Si]1(C)c2ccc(N(c3ccccc3)c3ccccc3)cc2-c2oc3cc(N(c4ccccc4)c4cccc5c4oc4ccccc45)ccc3c21
InChIInChI=1S/C46H34N2O2Si/c1-51(2)43-28-26-34(47(31-15-6-3-7-16-31)32-17-8-4-9-18-32)29-39(43)45-46(51)38-27-25-35(30-42(38)50-45)48(33-19-10-5-11-20-33)40-23-14-22-37-36-21-12-13-24-41(36)49-44(37)40/h3-30H,1-2H3
InChIKeyLOTYGCWLRWKDDL-UHFFFAOYSA-N
XLogP12.07
TPSA32.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500674.88
LogP ≤ 512.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-N,7-N-di(dibenzofuran-1-yl)-10,10-dimethyl-3-N,7-N-diphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine
CID 140845147
10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine
CID 159093716
3-N,7-N-di(dibenzofuran-1-yl)-10,10-dimethyl-3-N,7-N-bis(2-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine
CID 158790416
6-N,18-N-di(dibenzofuran-4-yl)-6-N,18-N-diphenyl-3,15-dioxahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4(9),5,7,11,14(22),16(21),17,19,23-undecaene-6,18-diamine
CID 162475564
10,10-dimethyl-3-N,3-N,8-N,8-N-tetraphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,8-diamine;3-N,3-N,8-N,8-N,10,10-hexakis-phenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,8-diamine
CID 157459074
9-N-dibenzofuran-4-yl-5-N,5-N,9-N-triphenylnaphtho[1,2-b][1]benzofuran-5,9-diamine
CID 155172997
N-dibenzofuran-4-yl-N-phenyl-10,22-dioxahexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1(24),2,4(9),5,7,11,13,15(23),16,18,20-undecaen-7-amine
CID 162475643
N-dibenzofuran-3-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine
CID 121241788
6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine
CID 167208512
N-dibenzofuran-3-yl-N-triphenylen-2-yldibenzofuran-4-amine
CID 166845761
N,N-diphenyldibenzofuran-4-amine;ethane
CID 158587957
3-N,3-N,7-N,7-N,10,10-hexakis-phenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine
CID 140845212

Frequently Asked Questions

What is the IUPAC name of 7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine?
The IUPAC name of 7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine (CID 140845196) is 7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine.
What is the SMILES notation for 7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine?
The canonical SMILES for 7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine is C[Si]1(C)c2ccc(N(c3ccccc3)c3ccccc3)cc2-c2oc3cc(N(c4ccccc4)c4cccc5c4oc4ccccc45)ccc3c21.
What is the InChIKey of 7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine?
The InChIKey is LOTYGCWLRWKDDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H34N2O2Si/c1-51(2)43-28-26-34(47(31-15-6-3-7-16-31)32-17-8-4-9-18-32)29-39(43)45-46(51)38-27-25-35(30-42(38)50-45)48(33-19-10-5-11-20-33)40-23-14-22-37-36-21-12-13-24-41(36)49-44(37)40/h3-30H,1-2H3.
What are the key properties of 7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine?
7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine has a molecular weight of 674.88 g/mol, XLogP of 12.07, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-N-dibenzofuran-4-yl-10,10-dimethyl-3-N,3-N,7-N-triphenyl-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine is sourced from PubChem (CID 140845196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).