[6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane

C29H27GeN3O — CID 164824338

IUPAC[6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane
SMILESCc1cc2nc(-c3cccc4c3oc3cc([Ge](C)(C)C)ccc34)n(-c3ccccc3)c2c(C)n1
InChIInChI=1S/C29H27GeN3O/c1-18-16-25-27(19(2)31-18)33(21-10-7-6-8-11-21)29(32-25)24-13-9-12-23-22-15-14-20(30(3,4)5)17-26(22)34-28(23)24/h6-17H,1-5H3
InChIKeyIOVHGXKPHUXDFK-UHFFFAOYSA-N
MW506.17 g/mol
LogP7.15
Rot. Bonds3

About [6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane

[6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane (PubChem CID 164824338) has the molecular formula C29H27GeN3O and a molecular weight of 506.17 g/mol. Its IUPAC name is [6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane.

Molecular Properties

Compound Name[6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane
PubChem CID164824338
Molecular FormulaC29H27GeN3O
Molecular Weight506.17 g/mol
Exact Mass507.14
IUPAC Name[6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane
SMILESCc1cc2nc(-c3cccc4c3oc3cc([Ge](C)(C)C)ccc34)n(-c3ccccc3)c2c(C)n1
InChIInChI=1S/C29H27GeN3O/c1-18-16-25-27(19(2)31-18)33(21-10-7-6-8-11-21)29(32-25)24-13-9-12-23-22-15-14-20(30(3,4)5)17-26(22)34-28(23)24/h6-17H,1-5H3
InChIKeyIOVHGXKPHUXDFK-UHFFFAOYSA-N
XLogP7.15
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms34
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500506.17
LogP ≤ 57.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane?
The IUPAC name of [6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane (CID 164824338) is [6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane.
What is the SMILES notation for [6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane?
The canonical SMILES for [6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane is Cc1cc2nc(-c3cccc4c3oc3cc([Ge](C)(C)C)ccc34)n(-c3ccccc3)c2c(C)n1.
What is the InChIKey of [6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane?
The InChIKey is IOVHGXKPHUXDFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H27GeN3O/c1-18-16-25-27(19(2)31-18)33(21-10-7-6-8-11-21)29(32-25)24-13-9-12-23-22-15-14-20(30(3,4)5)17-26(22)34-28(23)24/h6-17H,1-5H3.
What are the key properties of [6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane?
[6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane has a molecular weight of 506.17 g/mol, XLogP of 7.15, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4,6-dimethyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylgermane is sourced from PubChem (CID 164824338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).