(4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane

C29H26N2OSi — CID 162692418

IUPAC(4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane
SMILESCc1cc2ccc3c(-c4cccc5c4oc4ccccc45)ncnc3c2c(C)c1[Si](C)(C)C
InChIInChI=1S/C29H26N2OSi/c1-17-15-19-13-14-22-26(30-16-31-27(22)25(19)18(2)29(17)33(3,4)5)23-11-8-10-21-20-9-6-7-12-24(20)32-28(21)23/h6-16H,1-5H3
InChIKeyXOWWRIDKQABCDP-UHFFFAOYSA-N
MW446.63 g/mol
LogP7.51
Rot. Bonds2

About (4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane

(4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane (PubChem CID 162692418) has the molecular formula C29H26N2OSi and a molecular weight of 446.63 g/mol. Its IUPAC name is (4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane.

Molecular Properties

Compound Name(4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane
PubChem CID162692418
Molecular FormulaC29H26N2OSi
Molecular Weight446.63 g/mol
Exact Mass446.18
IUPAC Name(4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane
SMILESCc1cc2ccc3c(-c4cccc5c4oc4ccccc45)ncnc3c2c(C)c1[Si](C)(C)C
InChIInChI=1S/C29H26N2OSi/c1-17-15-19-13-14-22-26(30-16-31-27(22)25(19)18(2)29(17)33(3,4)5)23-11-8-10-21-20-9-6-7-12-24(20)32-28(21)23/h6-16H,1-5H3
InChIKeyXOWWRIDKQABCDP-UHFFFAOYSA-N
XLogP7.51
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.63
LogP ≤ 57.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

[8,10-dimethyl-4-(5-methyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[h]quinazolin-9-yl]-trimethylsilane
CID 176722750
4-dibenzofuran-4-yl-10-propan-2-ylbenzo[h]quinazoline
CID 162693258
4-dibenzofuran-4-yl-6-methylbenzo[h]quinazoline
CID 162692391
7-methyl-4-(7-phenyldibenzofuran-4-yl)benzo[h]quinazoline
CID 162693118
1-dibenzofuran-4-yl-3,5-dimethylnaphtho[1,2-h]quinazoline
CID 162693383
[4-([1]benzofuro[2,3-b]pyridin-8-yl)-10-methylbenzo[h]quinazolin-8-yl]-trimethylgermane
CID 176722779
8-(9-fluoro-8,10-dimethylbenzo[h]quinazolin-4-yl)-5-methyl-[1]benzofuro[2,3-b]pyridine
CID 162693306
(4-dibenzofuran-4-yl-10-methyl-2-propan-2-ylbenzo[h]quinazolin-8-yl)-trimethylgermane
CID 162693027
8-tert-butyl-4-dibenzofuran-4-ylbenzo[f]isoquinoline
CID 118566739
trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane
CID 162692592
3-dibenzofuran-4-yl-2-methylbenzo[g]quinoxaline
CID 159945205
4-(11-dibenzofuran-4-yl-6,7-dimethyltriphenylen-2-yl)dibenzofuran
CID 144568493

Frequently Asked Questions

What is the IUPAC name of (4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane?
The IUPAC name of (4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane (CID 162692418) is (4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane.
What is the SMILES notation for (4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane?
The canonical SMILES for (4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane is Cc1cc2ccc3c(-c4cccc5c4oc4ccccc45)ncnc3c2c(C)c1[Si](C)(C)C.
What is the InChIKey of (4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane?
The InChIKey is XOWWRIDKQABCDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N2OSi/c1-17-15-19-13-14-22-26(30-16-31-27(22)25(19)18(2)29(17)33(3,4)5)23-11-8-10-21-20-9-6-7-12-24(20)32-28(21)23/h6-16H,1-5H3.
What are the key properties of (4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane?
(4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane has a molecular weight of 446.63 g/mol, XLogP of 7.51, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane is sourced from PubChem (CID 162692418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).