trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane

C36H33GeN3O — CID 162692592

IUPACtrimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane
SMILESCc1ccc(-c2ccc3c(c2)oc2c(-c4nc(C)nc5c4ccc4cc(C)c([Ge](C)(C)C)c(C)c45)cccc23)cn1
InChIInChI=1S/C36H33GeN3O/c1-20-17-25-14-16-29-34(39-23(4)40-35(29)32(25)22(3)33(20)37(5,6)7)30-10-8-9-28-27-15-13-24(18-31(27)41-36(28)30)26-12-11-21(2)38-19-26/h8-19H,1-7H3
InChIKeyDROLTKOLQACFKK-UHFFFAOYSA-N
MW596.29 g/mol
LogP9.19
Rot. Bonds3

About trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane

trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane (PubChem CID 162692592) has the molecular formula C36H33GeN3O and a molecular weight of 596.29 g/mol. Its IUPAC name is trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane.

Molecular Properties

Compound Nametrimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane
PubChem CID162692592
Molecular FormulaC36H33GeN3O
Molecular Weight596.29 g/mol
Exact Mass597.18
IUPAC Nametrimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane
SMILESCc1ccc(-c2ccc3c(c2)oc2c(-c4nc(C)nc5c4ccc4cc(C)c([Ge](C)(C)C)c(C)c45)cccc23)cn1
InChIInChI=1S/C36H33GeN3O/c1-20-17-25-14-16-29-34(39-23(4)40-35(29)32(25)22(3)33(20)37(5,6)7)30-10-8-9-28-27-15-13-24(18-31(27)41-36(28)30)26-12-11-21(2)38-19-26/h8-19H,1-7H3
InChIKeyDROLTKOLQACFKK-UHFFFAOYSA-N
XLogP9.19
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500596.29
LogP ≤ 59.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-dibenzofuran-4-yl-3,5-dimethylnaphtho[1,2-h]quinazoline
CID 162693383
8-(2,10-dimethylbenzo[h]quinazolin-4-yl)-2-methyl-[1]benzofuro[2,3-b]pyridine
CID 162692686
(4-dibenzofuran-4-yl-8,10-dimethylbenzo[h]quinazolin-9-yl)-trimethylsilane
CID 162692418
7-methyl-4-(7-phenyldibenzofuran-4-yl)benzo[h]quinazoline
CID 162693118
[4-(2,5-dimethyl-[1]benzofuro[2,3-b]pyridin-8-yl)-8,10-dimethylbenzo[h]quinazolin-9-yl]-trimethylgermane
CID 162692980
(4-dibenzofuran-4-yl-10-methyl-2-propan-2-ylbenzo[h]quinazolin-8-yl)-trimethylgermane
CID 162693027
2-methyl-8-(2-methyl-10-propan-2-ylbenzo[h]quinazolin-4-yl)-[1]benzofuro[2,3-b]pyridine
CID 176722744
8-tert-butyl-4-(2,7-dimethyldibenzofuran-4-yl)-2,10-dimethylbenzo[h]quinazoline
CID 162692667
[4-([1]benzofuro[2,3-b]pyridin-8-yl)-10-methylbenzo[h]quinazolin-8-yl]-trimethylgermane
CID 176722779
6-phenyl-3-[6-(6-phenyldibenzofuran-3-yl)pyren-1-yl]dibenzofuran
CID 176846437
2-dibenzofuran-4-yl-5-naphthalen-2-ylpyridine
CID 171576906
5-methyl-2-[7-(4-methylphenyl)dibenzofuran-4-yl]-4-propan-2-ylpyridine
CID 166573825

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane?
The IUPAC name of trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane (CID 162692592) is trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane.
What is the SMILES notation for trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane?
The canonical SMILES for trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane is Cc1ccc(-c2ccc3c(c2)oc2c(-c4nc(C)nc5c4ccc4cc(C)c([Ge](C)(C)C)c(C)c45)cccc23)cn1.
What is the InChIKey of trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane?
The InChIKey is DROLTKOLQACFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H33GeN3O/c1-20-17-25-14-16-29-34(39-23(4)40-35(29)32(25)22(3)33(20)37(5,6)7)30-10-8-9-28-27-15-13-24(18-31(27)41-36(28)30)26-12-11-21(2)38-19-26/h8-19H,1-7H3.
What are the key properties of trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane?
trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane has a molecular weight of 596.29 g/mol, XLogP of 9.19, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2,8,10-trimethyl-4-[7-(6-methyl-3-pyridinyl)dibenzofuran-4-yl]benzo[h]quinazolin-9-yl]germane is sourced from PubChem (CID 162692592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).